| IconNMR Automation Run Status: | |
| Day Experiments: | 00:08 |
| Busy Until: | Tue 12:31 |
| Night Experiments: | 00:40 |
| Holder | Status | Name | ExpNo | Experiment | User | Time | Title |
| 1 | Completed | 20260907-1446-B400_B.11-1 | 10 | N H1_Day16 Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 min 30 sec | d08103sl | 00:01:30 | Ref sl-se-16 Group Leigh_D |
| 1 | Completed | 20260907-1446-B400_B.11-1 | 11 | N H1_Day16 Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 min 30 sec | d08103sl | 00:01:30 | Ref sl-se-16 Group Leigh_D |
| 2 | Completed | 20260907-1508-B400_B.11-2 | 10 | N H1_Day Proton, ns = 4, sw = 20 ppm, centre (o1p) = 6 ppm, time = 30 sec | f09303eg | 00:00:30 | Ref EG107 Group Webb_S |
| 2 | Completed | 20260907-1508-B400_B.11-2 | 11 | C H1_COSY_Day COSY, ns = 1, sw = auto, centre (o1p) = auto, time = 2 min 2 sec | f09303eg | 00:05:11 | Ref EG107 Group Webb_S |
| 2 | Completed | 20260907-1508-B400_B.11-2 | 12 | N C13_CPD_Day Carbon, proton decoupled, ns = 64, sw = 318 ppm, centre (o1p) = 115 ppm, time = 3 min 29 sec | f09303eg | 00:01:01 | Ref EG107 Group Webb_S |
| 3 | Completed | 20260907-1525-B400_B.11-3 | 10 | N H1_Day Proton, ns = 4, sw = 20 ppm, centre (o1p) = 6 ppm, time = 30 sec | f09303eg | 00:00:30 | Ref EG107 Group Webb_S |
| 3 | Completed | 20260907-1525-B400_B.11-3 | 11 | C H1_COSY_Day COSY, ns = 1, sw = auto, centre (o1p) = auto, time = 2 min 2 sec | f09303eg | 00:05:11 | Ref EG107 Group Webb_S |
| 3 | Completed | 20260907-1525-B400_B.11-3 | 12 | N C13_CPD_Day Carbon, proton decoupled, ns = 64, sw = 318 ppm, centre (o1p) = 115 ppm, time = 3 min 29 sec | f09303eg | 00:01:01 | Ref EG107 Group Webb_S |
| 5 | Completed | 20260907-1543-B400_B.11-5 | 10 | N H1_Day Proton, ns = 4, sw = 20 ppm, centre (o1p) = 6 ppm, time = 30 sec | z92209cg | 00:00:30 | Ref SX1-82-c1f1-1H Group Leigh_D |
| 6 | Completed | 20260907-1623-B400_B.11-6 | 10 | N H1_Day Proton, ns = 4, sw = 20 ppm, centre (o1p) = 6 ppm, time = 30 sec | m19368jb | 00:00:30 | Ref AK-JB116C Group Keerthi_A |
| 6 | Completed | 20260907-1623-B400_B.11-6 | 11 | C H1_COSY_Day COSY, ns = 1, sw = auto, centre (o1p) = auto, time = 2 min 2 sec | m19368jb | 00:05:11 | Ref AK-JB116C Group Keerthi_A |
| 7 | Completed | 20260907-1627-B400_B.11-7 | 10 | N H1_Day Proton, ns = 4, sw = 20 ppm, centre (o1p) = 6 ppm, time = 30 sec | p07890rp | 00:00:30 | Ref GDB-RP-114-DCM-extract Group De bo_G Extracted 114 crude mixture with DCM, evaporated and redissolved in CDCl3. |
| 7 | Completed | 20260907-1627-B400_B.11-7 | 11 | C H1_COSY_Day COSY, ns = 1, sw = auto, centre (o1p) = auto, time = 2 min 2 sec | p07890rp | 00:05:11 | Ref GDB-RP-114-DCM-extract Group De bo_G Extracted 114 crude mixture with DCM, evaporated and redissolved in CDCl3. |
| 8 | Completed | 20260907-1629-B400_B.11-8 | 10 | N H1_Day Proton, ns = 4, sw = 20 ppm, centre (o1p) = 6 ppm, time = 30 sec | p07890rp | 00:00:30 | Ref GDB-RP-111-DCM-layer Group De bo_G Sampled the DCM layer of 111 after quenching with water, evaporated and redissolved in MeOD. Filtered. |
| 8 | Completed | 20260907-1629-B400_B.11-8 | 11 | C H1_COSY_Day COSY, ns = 1, sw = auto, centre (o1p) = auto, time = 2 min 2 sec | p07890rp | 00:05:11 | Ref GDB-RP-111-DCM-layer Group De bo_G Sampled the DCM layer of 111 after quenching with water, evaporated and redissolved in MeOD. Filtered. |
| 9 | Completed | 20260907-1629-B400_B.11-9 | 10 | N H1_Day Proton, ns = 4, sw = 20 ppm, centre (o1p) = 6 ppm, time = 30 sec | p07890rp | 00:00:30 | Ref GDB-RP-111-DCM-layer Group De bo_G Sampled the DCM layer of 111 after quenching with water, evaporated and redissolved in acetone-d6. Filtered. |
| 9 | Completed | 20260907-1629-B400_B.11-9 | 11 | C H1_COSY_Day COSY, ns = 1, sw = auto, centre (o1p) = auto, time = 2 min 2 sec | p07890rp | 00:05:11 | Ref GDB-RP-111-DCM-layer Group De bo_G Sampled the DCM layer of 111 after quenching with water, evaporated and redissolved in acetone-d6. Filtered. |
| 10 | Completed | 20260907-0918-B400_B.11-10 | 17 | c H1_C13_HMBC_Night Proton-Carbon HMBC, ns = 4, sw = auto x 222 ppm, centre (o1p) = auto, 100 ppm, time = 33 min 53 sec | z86427mk | 00:34:17 | Ref MK-366 Group Procter_D |
| 11 | Completed | 20260907-1743-B400_B.11-11 | 10 | n H1_Night128 Proton, ns = 128, sw = 20 ppm, centre (o1p) = 6 ppm, time = 10 min 52 sec | x06125gb | 00:10:52 | Ref GCGBPhAcA3 Group Crisenza_G |
| 12 | Completed | 20260907-1322-B400_B.11-12 | 10 | n C13_CPD_Night1024 Carbon, , ns = 1024, sw = 318 ppm, centre (o1p) = 115 ppm, time = 52 min 51 sec | mbdxkrn2 | 00:52:51 | Ref GDB-RN1738 Full Char - Basic CDCl3 Group De bo_G |
| 12 | Completed | 20260907-1322-B400_B.11-12 | 11 | n H1_Night Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 min 30 sec | mbdxkrn2 | 00:01:30 | Ref GDB-RN1738 Full Char - Basic CDCl3 Group De bo_G |
| 12 | Completed | 20260907-1322-B400_B.11-12 | 12 | c H1_C13_HMBC_Night Proton-Carbon HMBC, ns = 4, sw = auto x 222 ppm, centre (o1p) = auto, 100 ppm, time = 33 min 53 sec | mbdxkrn2 | 00:34:17 | Ref GDB-RN1738 Full Char - Basic CDCl3 Group De bo_G |
| 12 | Completed | 20260907-1322-B400_B.11-12 | 13 | c H1_C13_HSQC_Night Proton-Carbon HSQC, ns = 2, sw = auto x 222 ppm, centre (o1p) = auto, 100 ppm, time = 14 min 21 sec | mbdxkrn2 | 00:14:29 | Ref GDB-RN1738 Full Char - Basic CDCl3 Group De bo_G |
| 12 | Completed | 20260907-1322-B400_B.11-12 | 14 | c H1_COSY_HiRes_Night COSY, ns = 1, sw = auto, centre (o1p) = auto, time =19 min 20 sec | mbdxkrn2 | 00:12:50 | Ref GDB-RN1738 Full Char - Basic CDCl3 Group De bo_G |
| 13 | Completed | 20260907-1323-B400_B.11-13 | 10 | n C13_CPD_Night1024 Carbon, , ns = 1024, sw = 318 ppm, centre (o1p) = 115 ppm, time = 52 min 51 sec | mbdxkrn2 | 00:52:51 | Ref GDB-RN1734 Full Char - Basic CDCl3 Group De bo_G |
| 13 | Completed | 20260907-1323-B400_B.11-13 | 11 | n H1_Night Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 min 30 sec | mbdxkrn2 | 00:01:30 | Ref GDB-RN1734 Full Char - Basic CDCl3 Group De bo_G |
| 13 | Completed | 20260907-1323-B400_B.11-13 | 12 | c H1_C13_HMBC_Night Proton-Carbon HMBC, ns = 4, sw = auto x 222 ppm, centre (o1p) = auto, 100 ppm, time = 33 min 53 sec | mbdxkrn2 | 00:34:17 | Ref GDB-RN1734 Full Char - Basic CDCl3 Group De bo_G |
| 13 | Completed | 20260907-1323-B400_B.11-13 | 13 | c H1_C13_HSQC_Night Proton-Carbon HSQC, ns = 2, sw = auto x 222 ppm, centre (o1p) = auto, 100 ppm, time = 14 min 21 sec | mbdxkrn2 | 00:14:29 | Ref GDB-RN1734 Full Char - Basic CDCl3 Group De bo_G |
| 13 | Completed | 20260907-1323-B400_B.11-13 | 14 | c H1_COSY_HiRes_Night COSY, ns = 1, sw = auto, centre (o1p) = auto, time =19 min 20 sec | mbdxkrn2 | 00:12:50 | Ref GDB-RN1734 Full Char - Basic CDCl3 Group De bo_G |
| 14 | Completed | 20260907-1800-B400_B.11-14 | 10 | n H1_Night Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 min 30 sec | m52750pm | 00:01:30 | Ref GCPM397F1H Group Crisenza_G |
| 14 | Completed | 20260907-1800-B400_B.11-14 | 11 | n C13_CPD_Night256 Carbon, , ns = 256, sw = 318 ppm, centre (o1p) = 115 ppm, time = 13 min 22 sec | m52750pm | 00:13:22 | Ref GCPM397F1C Group Crisenza_G |
| 14 | Completed | 20260907-1800-B400_B.11-14 | 12 | n C13_DEPT135_Night DEPT135, proton decoupled, ns = 512, sw = 318 ppm, centre (o1p) = 115 ppm, time = 26 min 21 sec | m52750pm | 00:26:21 | Ref GCPM397F1D Group Crisenza_G |
| 15 | Completed | 20260907-1800-B400_B.11-15 | 10 | n H1_Night Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 min 30 sec | m52750pm | 00:01:30 | Ref GCPM397F2 Group Crisenza_G |
| 15 | Completed | 20260907-1800-B400_B.11-15 | 11 | n C13_CPD_Night256 Carbon, , ns = 256, sw = 318 ppm, centre (o1p) = 115 ppm, time = 13 min 22 sec | m52750pm | 00:13:22 | Ref GCPM397F2 Group Crisenza_G |
| 15 | Completed | 20260907-1800-B400_B.11-15 | 12 | n C13_DEPT135_Night DEPT135, proton decoupled, ns = 512, sw = 318 ppm, centre (o1p) = 115 ppm, time = 26 min 21 sec | m52750pm | 00:26:21 | Ref GCPM397F2 Group Crisenza_G |
| 16 | Completed | 20260907-1800-B400_B.11-16 | 10 | n H1_Night Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 min 30 sec | m52750pm | 00:01:30 | Ref GCPM397F3 Group Crisenza_G |
| 17 | Completed | 20260907-1401-B400_B.11-17 | 10 | N H1_Day16 Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 min 30 sec | y52364mw | 00:01:30 | Ref GDB-MJ-D18-P3 Group De bo_G |
| 18 | Completed | 20260907-1401-B400_B.11-18 | 10 | N H1_Day16 Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 min 30 sec | y52364mw | 00:01:30 | Ref GDB-MJ-D18-P4 Group De bo_G |
| 19 | Completed | 20260907-1423-B400_B.11-19 | 10 | n H1_Night Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 min 30 sec | y52364mw | 00:01:30 | Ref GDB-MJ-D17-FULL Group De bo_G |
| 19 | Completed | 20260907-1423-B400_B.11-19 | 11 | n C13_CPD_Night1024 Carbon, , ns = 1024, sw = 318 ppm, centre (o1p) = 115 ppm, time = 52 min 51 sec | y52364mw | 00:52:51 | Ref GDB-MJ-D17-FULL Group De bo_G |
| 19 | Completed | 20260907-1423-B400_B.11-19 | 12 | c H1_COSY_HiRes_Night COSY, ns = 1, sw = auto, centre (o1p) = auto, time =19 min 20 sec | y52364mw | 00:12:50 | Ref GDB-MJ-D17-FULL Group De bo_G |
| 19 | Completed | 20260907-1423-B400_B.11-19 | 13 | c H1_C13_HSQC_Night Proton-Carbon HSQC, ns = 2, sw = auto x 222 ppm, centre (o1p) = auto, 100 ppm, time = 14 min 21 sec | y52364mw | 00:14:29 | Ref GDB-MJ-D17-FULL Group De bo_G |
| 19 | Completed | 20260907-1423-B400_B.11-19 | 14 | c H1_C13_HMBC_Night Proton-Carbon HMBC, ns = 4, sw = auto x 222 ppm, centre (o1p) = auto, 100 ppm, time = 33 min 53 sec | y52364mw | 00:34:17 | Ref GDB-MJ-D17-FULL Group De bo_G |
| 20 | Completed | 20260907-1438-B400_B.11-20 | 10 | N H1_Day16 Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 min 30 sec | y52364mw | 00:01:30 | Ref GDB-MJ-D18-P2 Group De bo_G |
| 21 | Completed | 20260907-1958-B400_B.11-21 | 10 | N H1_Day Proton, ns = 4, sw = 20 ppm, centre (o1p) = 6 ppm, time = 30 sec | a53046hl | 00:00:30 | Ref ph-787-fuel Group Leigh_D 4h |
| 21 | Completed | 20260907-1958-B400_B.11-21 | 11 | N H1_Day Proton, ns = 4, sw = 20 ppm, centre (o1p) = 6 ppm, time = 30 sec | a53046hl | 00:00:30 | Ref ph-787-fuel Group Leigh_D 4h |
| 24 | Completed | 20260908-1022-B400_B.11-24 | 10 | N H1_Day16 Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 min 30 sec | h32367lm | 00:01:30 | Ref LM_FCat_LAH_2wk Group Leigh_D |
| 25 | Completed | 20260908-1023-B400_B.11-25 | 10 | N H1_Day16 Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 min 30 sec | h32367lm | 00:01:30 | Ref LM_FCat_LAH_Bigbatch Group Leigh_D |
| 26 | Completed | 20260908-1029-B400_B.11-26 | 10 | N H1_Day Proton, ns = 4, sw = 20 ppm, centre (o1p) = 6 ppm, time = 30 sec | w12998gm | 00:00:30 | Ref il-gm-11-034-distilled Group Larrosa_I |
| 26 | Completed | 20260908-1029-B400_B.11-26 | 11 | N F19_NoCPD_Day Fluorine, ns = 16, sw = 237 ppm, centre (o1p) = -100 ppm, time = 50 sec | w12998gm | 00:00:50 | Ref il-gm-11-034-distilled Group Larrosa_I |
| 26 | Submitted | 20260908-1029-B400_B.11-26 | 12 | n C13_CPD_Night256 Carbon, , ns = 256, sw = 318 ppm, centre (o1p) = 115 ppm, time = 13 min 22 sec | w12998gm | 00:13:22 | Ref il-gm-11-034-distilled Group Larrosa_I |
| 27 | Completed | 20260908-1032-B400_B.11-27 | 10 | N H1_Day16 Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 min 30 sec | m14269jw | 00:01:30 | Ref IR-JW-PD5 Group Riddell_I |
| 28 | Completed | 20260908-1040-B400_B.11-28 | 10 | N H1_Day16 Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 min 30 sec | m14269jw | 00:01:30 | Ref IR-JW-PD2.3 FeBF4 Group Riddell_I Benzidine + FeBF4 1:1 ratio |
| 29 | Completed | 20260908-1041-B400_B.11-29 | 10 | N H1_Day16 Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 min 30 sec | m14269jw | 00:01:30 | Ref IR-JW-PD2.10 NiBF4 Group Riddell_I Benzidine + NiBF4 1:1 Ratio |
| 29 | Completed | 20260908-1041-B400_B.11-29 | 11 | N H1_Wide_Day Proton, ns = 16, sw = 100 ppm, centre (o1p) = -5 ppm, time = 1 min 21 sec | m14269jw | 00:00:49 | Ref IR-JW-PD2.10 NiBF4 Group Riddell_I Benzidine + NiBF4 1:1 Ratio |
| 29 | Completed | 20260908-1041-B400_B.11-29 | 12 | N H1_ExtraWide_Day Proton, ns = 16, sw = 400 ppm, centre (o1p) = -5 ppm, time = 1 min 21 sec | m14269jw | 00:00:16 | Ref IR-JW-PD2.10 NiBF4 Group Riddell_I Benzidine + NiBF4 1:1 Ratio |
| 30 | Completed | 20260908-1041-B400_B.11-30 | 10 | N H1_Day16 Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 min 30 sec | m14269jw | 00:01:30 | Ref IR-JW-PD6.1 ZnNTf2 Group Riddell_I Pyrene Ligand + ZnNTf2 |
| 31 | Completed | 20260908-1049-B400_B.11-31 | 10 | N H1_Day16 Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 min 30 sec | h32367lm | 00:01:30 | Ref LM_FCat_LAH_Bigbatch_MeOD Group Leigh_D |
| 32 | Completed | 20260908-1050-B400_B.11-32 | 10 | N H1_Day16 Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 min 30 sec | x06125gb | 00:01:30 | Ref GCGB49410-16 Group Crisenza_G |
| 33 | Completed | 20260908-1055-B400_B.11-33 | 10 | N H1_Day Proton, ns = 4, sw = 20 ppm, centre (o1p) = 6 ppm, time = 30 sec | a53046hl | 00:00:30 | Ref QBB-G158-C2F7 Group Leigh_D |
| 34 | Completed | 20260908-1059-B400_B.11-34 | 10 | N H1_Day16 Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 min 30 sec | n29715ss | 00:01:30 | Ref DJP-SS-newBcattest Group Procter_D |
| 34 | Completed | 20260908-1059-B400_B.11-34 | 11 | N B11_NoCPD_Day Boron, ns = 16, sw = 298 ppm, centre (o1p) = 0 ppm, time = 6 sec | n29715ss | 00:00:45 | Ref DJP-SS-newBcattest Group Procter_D |
| 35 | Completed | 20260908-1105-B400_B.11-35 | 10 | N H1_Quant_D1_25s_Day | n44021ma | 00:08:42 | Ref MA33_a Group Shaver_M |
| 36 | Completed | 20260908-1105-B400_B.11-36 | 10 | N H1_Quant_D1_25s_Day | n44021ma | 00:08:42 | Ref MA33_b Group Shaver_M |
| 37 | Completed | 20260908-1106-B400_B.11-37 | 10 | N H1_Quant_D1_25s_Day | n44021ma | 00:08:42 | Ref MA33_c Group Shaver_M |
| 38 | Running | 20260908-1114-B400_B.11-38 | 10 | N H1_Day16 Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 min 30 sec | m14269jw | 00:01:30 | Ref IR-JW-PD5-2BEMEReference Group Riddell_I 2-Bromoethyl Methyl Ether in MeCN |
| 39 | Submitted | 20260908-1158-B400_B.11-39 | 10 | N H1_Day16 Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 min 30 sec | h32367lm | 00:01:30 | Ref LM_FCat_2wk_MeOD Group Leigh_D |
| 40 | Submitted | 20260908-1121-B400_B.11-40 | 10 | N H1_Day16 Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 min 30 sec | m46745sw | 00:01:30 | Ref PUMP3-S-R-PRE Group Natrajan_L |
| 41 | Submitted | 20260908-1150-B400_B.11-41 | 10 | N H1_Day Proton, ns = 4, sw = 20 ppm, centre (o1p) = 6 ppm, time = 30 sec | z16689fe | 00:00:30 | Ref DJP TL 072 Group Procter_D |
| 41 | Submitted | 20260908-1150-B400_B.11-41 | 11 | N C13_CPD_Day Carbon, proton decoupled, ns = 64, sw = 318 ppm, centre (o1p) = 115 ppm, time = 3 min 29 sec | z16689fe | 00:01:01 | Ref DJP TL 072 Group Procter_D |
| 42 | Submitted | 20260908-1150-B400_B.11-42 | 10 | N H1_Day Proton, ns = 4, sw = 20 ppm, centre (o1p) = 6 ppm, time = 30 sec | z16689fe | 00:00:30 | Ref DJP TL 069 on 400M Group Procter_D |
| 42 | Submitted | 20260908-1150-B400_B.11-42 | 11 | n H1_Night Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 min 30 sec | z16689fe | 00:01:30 | Ref DJP TL 069 on 400M Group Procter_D |
| 42 | Submitted | 20260908-1150-B400_B.11-42 | 12 | c H1_NOESY_Night NOESY, ns = 4, sw = auto, centre (o1p) = auto, time =12 min 1 sec | z16689fe | 00:12:04 | Ref DJP TL 069 on 400M Group Procter_D |
| 43 | Submitted | 20260908-1152-B400_B.11-43 | 10 | n H1_Night Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 min 30 sec | z16689fe | 00:01:30 | Ref DJP TL 071 on 400M Group Procter_D |
| 43 | Submitted | 20260908-1152-B400_B.11-43 | 11 | c H1_NOESY_Night NOESY, ns = 4, sw = auto, centre (o1p) = auto, time =12 min 1 sec | z16689fe | 00:12:04 | Ref DJP TL 071 on400M Group Procter_D |
| 44 | Submitted | 20260908-1158-B400_B.11-44 | 10 | N H1_Day16 Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 min 30 sec | h32367lm | 00:01:30 | Ref LM_FMac_Amide_MeOD Group Leigh_D |
| Holder | Time | Name | ExpNo | Experiment | User | Load | Atma | Spin | Lock | Shim | Acq | Proc | Title | Remarks |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 38 | 11:59:58 | 20260908-1114-B400_B.11-38 | 10 | H1_Day16 | m14269jw | - | - | - | - | - | - | - | Ref IR-JW-PD5-2BEMEReference Group Riddell_I 2-Bromoethyl Methyl Ether in MeCN | |
| 37 | 11:48:30 | 20260908-1106-B400_B.11-37 | 10 | H1_Quant_D1_25s_Day | n44021ma | + | + | - | + | + | + | + | Ref MA33_c Group Shaver_M | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 36 | 11:37:03 | 20260908-1105-B400_B.11-36 | 10 | H1_Quant_D1_25s_Day | n44021ma | + | + | - | + | + | + | + | Ref MA33_b Group Shaver_M | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 35 | 11:25:07 | 20260908-1105-B400_B.11-35 | 10 | H1_Quant_D1_25s_Day | n44021ma | + | + | - | + | + | + | + | Ref MA33_a Group Shaver_M | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 34 | 11:22:52 | 20260908-1059-B400_B.11-34 | 11 | B11_NoCPD_Day | n29715ss | - | + | - | - | - | + | + | Ref DJP-SS-newBcattest Group Procter_D | log_err: acqt0 not set in pulse program, result may be incorrect!, log_err: acqt0 not set in pulse program, result may be incorrect!, sref: NUCLEUS '11B' not defined for SOLVENT 'CDCl3' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Procter_D/data/n29715ss/nmr/20260908-1059-B400_B.11-34/11/pdata/1/peaks!, sref: NUCLEUS '11B' not defined for SOLVENT 'CDCl3' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Procter_D/data/n29715ss/nmr/20260908-1059-B400_B.11-34/11/pdata/1/peaks! |
| 34 | 11:17:28 | 20260908-1059-B400_B.11-34 | 10 | H1_Day16 | n29715ss | + | + | - | + | + | + | + | Ref DJP-SS-newBcattest Group Procter_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 33 | 11:12:56 | 20260908-1055-B400_B.11-33 | 10 | H1_Day | a53046hl | + | + | - | + | + | + | + | Ref QBB-G158-C2F7 Group Leigh_D | |
| 32 | 11:08:13 | 20260908-1050-B400_B.11-32 | 10 | H1_Day16 | x06125gb | + | + | - | + | + | + | + | Ref GCGB49410-16 Group Crisenza_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 31 | 11:03:49 | 20260908-1049-B400_B.11-31 | 10 | H1_Day16 | h32367lm | + | + | - | + | + | + | + | Ref LM_FCat_LAH_Bigbatch_MeOD Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 30 | 10:58:52 | 20260908-1041-B400_B.11-30 | 10 | H1_Day16 | m14269jw | + | + | - | + | + | + | + | Ref IR-JW-PD6.1 ZnNTf2 Group Riddell_I Pyrene Ligand + ZnNTf2 | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 29 | 10:58:00 | 20260908-1041-B400_B.11-29 | 12 | H1_ExtraWide_Day | m14269jw | - | + | - | - | - | + | + | Ref IR-JW-PD2.10 NiBF4 Group Riddell_I Benzidine + NiBF4 1:1 Ratio | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 29 | 10:56:30 | 20260908-1041-B400_B.11-29 | 11 | H1_Wide_Day | m14269jw | - | + | - | - | - | + | + | Ref IR-JW-PD2.10 NiBF4 Group Riddell_I Benzidine + NiBF4 1:1 Ratio | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 29 | 10:52:13 | 20260908-1041-B400_B.11-29 | 10 | H1_Day16 | m14269jw | + | + | - | + | + | + | + | Ref IR-JW-PD2.10 NiBF4 Group Riddell_I Benzidine + NiBF4 1:1 Ratio | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 28 | 10:46:46 | 20260908-1040-B400_B.11-28 | 10 | H1_Day16 | m14269jw | + | + | - | + | + | + | + | Ref IR-JW-PD2.3 FeBF4 Group Riddell_I Benzidine + FeBF4 1:1 ratio | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 27 | 10:42:12 | 20260908-1032-B400_B.11-27 | 10 | H1_Day16 | m14269jw | + | + | - | + | + | + | + | Ref IR-JW-PD5 Group Riddell_I | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 26 | 10:40:09 | 20260908-1029-B400_B.11-26 | 11 | F19_NoCPD_Day | w12998gm | - | + | - | - | - | + | + | Ref il-gm-11-034-distilled Group Larrosa_I | log_err: acqt0 not set in pulse program, result may be incorrect!, log_err: acqt0 not set in pulse program, result may be incorrect!, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0 |
| 26 | 10:34:06 | 20260908-1029-B400_B.11-26 | 10 | H1_Day | w12998gm | + | + | - | + | + | + | + | Ref il-gm-11-034-distilled Group Larrosa_I | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 25 | 10:28:21 | 20260908-1023-B400_B.11-25 | 10 | H1_Day16 | h32367lm | + | + | - | + | + | + | + | Ref LM_FCat_LAH_Bigbatch Group Leigh_D | |
| 24 | 10:23:06 | 20260908-1022-B400_B.11-24 | 10 | H1_Day16 | h32367lm | + | + | - | + | + | + | + | Ref LM_FCat_LAH_2wk Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 21 | 02:10:38 | 20260907-1958-B400_B.11-21 | 11 | H1_Day | a53046hl | + | + | - | + | + | + | + | Ref ph-787-fuel Group Leigh_D 4h | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 15 | 01:43:24 | 20260907-1800-B400_B.11-15 | 12 | C13_DEPT135_Night | m52750pm | - | + | - | - | - | + | + | Ref GCPM397F2 Group Crisenza_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 15 | 01:29:08 | 20260907-1800-B400_B.11-15 | 11 | C13_CPD_Night256 | m52750pm | - | + | - | - | - | + | + | Ref GCPM397F2 Group Crisenza_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 15 | 01:24:44 | 20260907-1800-B400_B.11-15 | 10 | H1_Night | m52750pm | + | + | - | + | + | + | + | Ref GCPM397F2 Group Crisenza_G | |
| 14 | 00:57:29 | 20260907-1800-B400_B.11-14 | 12 | C13_DEPT135_Night | m52750pm | - | + | - | - | - | + | + | Ref GCPM397F1D Group Crisenza_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 14 | 00:43:13 | 20260907-1800-B400_B.11-14 | 11 | C13_CPD_Night256 | m52750pm | - | + | - | - | - | + | + | Ref GCPM397F1C Group Crisenza_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 14 | 00:37:23 | 20260907-1800-B400_B.11-14 | 10 | H1_Night | m52750pm | + | + | - | + | + | + | + | Ref GCPM397F1H Group Crisenza_G | |
| 19 | 00:02:14 | 20260907-1423-B400_B.11-19 | 14 | H1_C13_HMBC_Night | y52364mw | - | + | - | - | - | + | + | Ref GDB-MJ-D17-FULL Group De bo_G | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 19 | 23:46:53 | 20260907-1423-B400_B.11-19 | 13 | H1_C13_HSQC_Night | y52364mw | - | + | - | - | - | + | + | Ref GDB-MJ-D17-FULL Group De bo_G | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 19 | 23:33:20 | 20260907-1423-B400_B.11-19 | 12 | H1_COSY_HiRes_Night | y52364mw | - | + | - | - | - | + | + | Ref GDB-MJ-D17-FULL Group De bo_G | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 19 | 22:36:52 | 20260907-1423-B400_B.11-19 | 11 | C13_CPD_Night1024 | y52364mw | + | + | - | + | + | + | + | Ref GDB-MJ-D17-FULL Group De bo_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 13 | 22:23:24 | 20260907-1323-B400_B.11-13 | 14 | H1_COSY_HiRes_Night | mbdxkrn2 | - | + | - | - | - | + | + | Ref GDB-RN1734 Full Char - Basic CDCl3 Group De bo_G | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 13 | 22:08:03 | 20260907-1323-B400_B.11-13 | 13 | H1_C13_HSQC_Night | mbdxkrn2 | - | + | - | - | - | + | + | Ref GDB-RN1734 Full Char - Basic CDCl3 Group De bo_G | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 13 | 21:32:54 | 20260907-1323-B400_B.11-13 | 12 | H1_C13_HMBC_Night | mbdxkrn2 | - | + | - | - | - | + | + | Ref GDB-RN1734 Full Char - Basic CDCl3 Group De bo_G | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 13 | 21:30:35 | 20260907-1323-B400_B.11-13 | 11 | H1_Night | mbdxkrn2 | - | + | - | - | - | + | + | Ref GDB-RN1734 Full Char - Basic CDCl3 Group De bo_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 13 | 20:33:46 | 20260907-1323-B400_B.11-13 | 10 | C13_CPD_Night1024 | mbdxkrn2 | + | + | - | + | + | + | + | Ref GDB-RN1734 Full Char - Basic CDCl3 Group De bo_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 21 | 20:30:19 | 20260907-1958-B400_B.11-21 | 10 | H1_Day | a53046hl | + | + | - | + | + | + | + | Ref ph-787-fuel Group Leigh_D 4h | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 12 | 20:16:53 | 20260907-1322-B400_B.11-12 | 14 | H1_COSY_HiRes_Night | mbdxkrn2 | - | + | - | - | - | + | + | Ref GDB-RN1738 Full Char - Basic CDCl3 Group De bo_G | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 12 | 20:01:32 | 20260907-1322-B400_B.11-12 | 13 | H1_C13_HSQC_Night | mbdxkrn2 | - | + | - | - | - | + | + | Ref GDB-RN1738 Full Char - Basic CDCl3 Group De bo_G | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 12 | 19:26:24 | 20260907-1322-B400_B.11-12 | 12 | H1_C13_HMBC_Night | mbdxkrn2 | - | + | - | - | - | + | + | Ref GDB-RN1738 Full Char - Basic CDCl3 Group De bo_G | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 12 | 19:24:11 | 20260907-1322-B400_B.11-12 | 11 | H1_Night | mbdxkrn2 | - | + | - | - | - | + | + | Ref GDB-RN1738 Full Char - Basic CDCl3 Group De bo_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 12 | 18:28:29 | 20260907-1322-B400_B.11-12 | 10 | C13_CPD_Night1024 | mbdxkrn2 | + | + | - | + | + | + | + | Ref GDB-RN1738 Full Char - Basic CDCl3 Group De bo_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 16 | 18:22:58 | 20260907-1800-B400_B.11-16 | 10 | H1_Night | m52750pm | + | + | - | + | + | + | + | Ref GCPM397F3 Group Crisenza_G | |
| 11 | 18:07:42 | 20260907-1743-B400_B.11-11 | 10 | H1_Night128 | x06125gb | + | + | - | + | + | + | + | Ref GCGBPhAcA3 Group Crisenza_G | |
| 10 | 17:30:07 | 20260907-0918-B400_B.11-10 | 17 | H1_C13_HMBC_Night | z86427mk | + | + | - | + | + | + | + | Ref MK-366 Group Procter_D | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 16 | 17:18:14 | 20260907-1644-B400_B.11-16 | 10 | H1_Day | u67812sg | + | + | - | + | + | + | + | Ref sq-2-80-3 Group Procter_D | |
| 15 | 17:14:12 | 20260907-1643-B400_B.11-15 | 10 | H1_Day | u67812sg | + | + | - | + | + | + | + | Ref sq-2-80-2 Group Procter_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 14 | 17:10:35 | 20260907-1643-B400_B.11-14 | 10 | H1_Day | u67812sg | + | + | - | + | + | + | + | Ref sq-2-80-1 Group Procter_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 11 | 17:04:24 | 20260907-1645-B400_B.11-11 | 10 | H1_Day16 | d08103sl | + | + | - | + | + | + | + | Ref sl-se-14 cdcl3 Group Leigh_D | |
| 9 | 16:58:33 | 20260907-1629-B400_B.11-9 | 11 | H1_COSY_Day | p07890rp | - | + | - | - | - | + | + | Ref GDB-RP-111-DCM-layer Group De bo_G Sampled the DCM layer of 111 after quenching with water, evaporated and redissolved in acetone-d6. Filtered. | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 9 | 16:55:06 | 20260907-1629-B400_B.11-9 | 10 | H1_Day | p07890rp | + | + | - | + | + | + | + | Ref GDB-RP-111-DCM-layer Group De bo_G Sampled the DCM layer of 111 after quenching with water, evaporated and redissolved in acetone-d6. Filtered. | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 8 | 16:49:16 | 20260907-1629-B400_B.11-8 | 11 | H1_COSY_Day | p07890rp | - | + | - | - | - | + | + | Ref GDB-RP-111-DCM-layer Group De bo_G Sampled the DCM layer of 111 after quenching with water, evaporated and redissolved in MeOD. Filtered. | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 8 | 16:44:55 | 20260907-1629-B400_B.11-8 | 10 | H1_Day | p07890rp | + | + | - | + | + | + | + | Ref GDB-RP-111-DCM-layer Group De bo_G Sampled the DCM layer of 111 after quenching with water, evaporated and redissolved in MeOD. Filtered. | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 7 | 16:39:04 | 20260907-1627-B400_B.11-7 | 11 | H1_COSY_Day | p07890rp | - | + | - | - | - | + | + | Ref GDB-RP-114-DCM-extract Group De bo_G Extracted 114 crude mixture with DCM, evaporated and redissolved in CDCl3. | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 7 | 16:34:17 | 20260907-1627-B400_B.11-7 | 10 | H1_Day | p07890rp | + | + | - | + | + | + | + | Ref GDB-RP-114-DCM-extract Group De bo_G Extracted 114 crude mixture with DCM, evaporated and redissolved in CDCl3. | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 6 | 16:28:27 | 20260907-1623-B400_B.11-6 | 11 | H1_COSY_Day | m19368jb | - | + | - | - | - | + | + | Ref AK-JB116C Group Keerthi_A | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 6 | 16:24:26 | 20260907-1623-B400_B.11-6 | 10 | H1_Day | m19368jb | + | + | - | + | + | + | + | Ref AK-JB116C Group Keerthi_A | |
| 5 | 15:44:16 | 20260907-1543-B400_B.11-5 | 10 | H1_Day | z92209cg | + | + | - | + | + | + | + | Ref SX1-82-c1f1-1H Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 3 | 15:37:51 | 20260907-1525-B400_B.11-3 | 12 | C13_CPD_Day | f09303eg | - | + | - | - | - | + | + | Ref EG107 Group Webb_S | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 3 | 15:32:00 | 20260907-1525-B400_B.11-3 | 11 | H1_COSY_Day | f09303eg | - | + | - | - | - | + | + | Ref EG107 Group Webb_S | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 3 | 15:26:48 | 20260907-1525-B400_B.11-3 | 10 | H1_Day | f09303eg | + | + | - | + | + | + | + | Ref EG107 Group Webb_S | |
| 2 | 15:22:04 | 20260907-1508-B400_B.11-2 | 12 | C13_CPD_Day | f09303eg | - | + | - | - | - | + | + | Ref EG107 Group Webb_S | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 2 | 15:16:13 | 20260907-1508-B400_B.11-2 | 11 | H1_COSY_Day | f09303eg | - | + | - | - | - | + | + | Ref EG107 Group Webb_S | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 2 | 15:10:21 | 20260907-1508-B400_B.11-2 | 10 | H1_Day | f09303eg | + | + | - | + | + | + | + | Ref EG107 Group Webb_S | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 1 | 14:52:23 | 20260907-1446-B400_B.11-1 | 11 | H1_Day16 | d08103sl | - | + | - | - | - | + | + | Ref sl-se-16 Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 1 | 14:46:59 | 20260907-1446-B400_B.11-1 | 10 | H1_Day16 | d08103sl | + | + | - | + | + | + | + | Ref sl-se-16 Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 20 | 14:39:11 | 20260907-1438-B400_B.11-20 | 10 | H1_Day16 | y52364mw | + | + | - | + | + | + | + | Ref GDB-MJ-D18-P2 Group De bo_G | |
| 19 | 14:25:04 | 20260907-1423-B400_B.11-19 | 10 | H1_Night | y52364mw | + | + | - | + | + | + | + | Ref GDB-MJ-D17-FULL Group De bo_G | |
| 18 | 14:16:51 | 20260907-1401-B400_B.11-18 | 10 | H1_Day16 | y52364mw | + | + | - | + | + | + | + | Ref GDB-MJ-D18-P4 Group De bo_G | |
| 17 | 14:11:24 | 20260907-1401-B400_B.11-17 | 10 | H1_Day16 | y52364mw | + | + | - | + | + | + | + | Ref GDB-MJ-D18-P3 Group De bo_G | |
| 16 | 14:05:36 | 20260907-1401-B400_B.11-16 | 10 | H1_Day16 | y52364mw | + | + | - | + | + | + | + | Ref GDB-MJ-D18-P2 Group De bo_G | |
| 15 | 14:01:03 | 20260907-1359-B400_B.11-15 | 10 | H1_Day16 | y52364mw | + | + | - | + | + | + | + | Ref GDB-MJ-D18-P1 Group De bo_G | |
| 14 | 13:52:15 | 20260907-1347-B400_B.11-14 | 11 | B11_CPD_Day | z88883sp | - | + | - | - | - | + | + | Ref SP444a Group Romanov_A | sref: NUCLEUS '11B' not defined for SOLVENT 'CDCl3' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Romanov_A/data/z88883sp/nmr/20260907-1347-B400_B.11-14/11/pdata/1/peaks!, sref: NUCLEUS '11B' not defined for SOLVENT 'CDCl3' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Romanov_A/data/z88883sp/nmr/20260907-1347-B400_B.11-14/11/pdata/1/peaks! |
| 14 | 13:47:46 | 20260907-1347-B400_B.11-14 | 10 | H1_Day | z88883sp | + | + | - | + | + | + | + | Ref SP444a Group Romanov_A | |
| 11 | 13:21:48 | 20260907-1320-B400_B.11-11 | 10 | H1_Day16 | mbdxkrn2 | + | + | - | + | + | + | + | Ref GDB-RN1408-20 (325 mg) + SP-NO2 (4.0 mg) - Basic CDCl3 Group De bo_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 10 | 09:57:21 | 20260907-0918-B400_B.11-10 | 16 | H1_C13_HSQC_Night | z86427mk | - | + | - | - | - | + | + | Ref MK-366 Group Procter_D | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, Automation was stopped by user |
| 10 | 09:43:53 | 20260907-0918-B400_B.11-10 | 15 | H1_COSY_HiRes_Night | z86427mk | - | + | - | - | - | + | + | Ref MK-366 Group Procter_D | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 10 | 09:29:31 | 20260907-0918-B400_B.11-10 | 14 | C13_CPD_Night256 | z86427mk | - | + | - | - | - | + | + | Ref MK-366 Group Procter_D | |
| 10 | 09:26:38 | 20260907-0918-B400_B.11-10 | 13 | H1_Night | z86427mk | - | + | - | - | - | + | + | Ref MK-366 Group Procter_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 10 | 09:24:44 | 20260907-0918-B400_B.11-10 | 12 | F19_NoCPD_Day | z86427mk | - | + | - | - | - | + | + | Ref MK-366 Group Procter_D | log_err: acqt0 not set in pulse program, result may be incorrect!, log_err: acqt0 not set in pulse program, result may be incorrect!, sref: reference peak outside file limits default calibration done, sref: reference peak outside file limits default calibration done |
| 10 | 09:22:18 | 20260907-0918-B400_B.11-10 | 11 | C13_CPD_Day | z86427mk | - | + | - | - | - | + | + | Ref MK-366 Group Procter_D | |
| 10 | 09:19:11 | 20260907-0918-B400_B.11-10 | 10 | H1_Day | z86427mk | + | + | - | + | + | + | + | Ref MK-366 Group Procter_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 4 | 08:42:20 | 20260907-0831-B400_B.11-3 | 20 | H1_Day16 | v73981ac | + | + | - | + | + | + | + | Ref IL-AC-ANG-03 Group Larrosa_I | |
| 3 | 08:36:56 | 20260907-0831-B400_B.11-3 | 10 | H1_Quant_NS1_Day | v73981ac | + | + | - | + | + | + | + | Ref IL-AC-ANG-21-p2 Group Larrosa_I | |
| 15 | 08:32:26 | 20260907-0750-B400_B.11-15 | 10 | H1_Day16 | m14269jw | + | + | - | + | + | + | + | Ref IR-JW-PD2.9 CoBF4 Group Riddell_I Benzidine+CoBF4 48hrsHeated60C | |
| 14 | 08:28:23 | 20260907-0750-B400_B.11-14 | 10 | H1_Day16 | m14269jw | + | + | - | + | + | + | + | Ref IR-JW-PD2.8 CdClO4 Group Riddell_I Benzidine+CdClO4 48hrsHeated60C | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 13 | 08:24:16 | 20260907-0750-B400_B.11-13 | 10 | H1_Day16 | m14269jw | + | + | - | + | + | + | + | Ref IR-JW-PD2.7 ZnOTf Group Riddell_I Benzidine+ZNOTf 48hrsHeated60C | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 9 | 08:20:01 | 20260907-0748-B400_B.11-9 | 10 | H1_Day16 | m14269jw | + | + | - | + | + | + | + | Ref IR-JW-PD2.6 ZnBF4 Group Riddell_I Benzidine+ZnBF4 48hrsHeated60C | |
| 8 | 08:15:49 | 20260907-0746-B400_B.11-8 | 10 | H1_Day16 | m14269jw | + | + | - | + | + | + | + | Ref IR-JW-PD2.5 FeOTf Group Riddell_I Benzidine+FeOTf 48hrsHeated60C | |
| 7 | 08:11:40 | 20260907-0746-B400_B.11-7 | 10 | H1_Day16 | m14269jw | + | + | - | + | + | + | + | Ref IR-JW-PD2.4 FeClO4 Group Riddell_I Benzidine+FeClO4 48hrsHeated60C | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 6 | 08:07:08 | 20260907-0744-B400_B.11-6 | 10 | H1_Day16 | m14269jw | + | + | - | + | + | + | + | Ref IR-JW-PD2.1 FeNTf2 Group Riddell_I Benzidine+FeNTf2 48hrsHeated60C | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 5 | 08:05:08 | 20260907-0731-B400_B.11-3 | 4080432 | P31_NoCPD_Day | w05220ss | - | + | - | - | - | + | + | Ref JA-SiS-IV-08 Group Abbenseth_J JA-SiS-IV-08 P-Mes - 31P | sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0 |
| 5 | 08:03:24 | 20260907-0731-B400_B.11-3 | 4080431 | P31_Wide_Day | w05220ss | - | + | - | - | - | + | + | Ref JA-SiS-IV-08 Group Abbenseth_J JA-SiS-IV-08 P-Mes - 31P | sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0 |
| 5 | 08:01:57 | 20260907-0731-B400_B.11-3 | 4080402 | H1_P31CPD_Day | w05220ss | - | + | - | - | - | + | + | Ref JA-SiS-IV-08 Group Abbenseth_J JA-SiS-IV-08 P-Mes - 1H{1H} | |
| 5 | 07:56:23 | 20260907-0731-B400_B.11-3 | 4080401 | H1_Day16 | w05220ss | + | + | - | + | + | + | + | Ref JA-SiS-IV-08 Group Abbenseth_J JA-SiS-IV-08 P-Mes - 1H | |
| 4 | 07:54:32 | 20260907-0731-B400_B.11-3 | 4060519 | F19_NoCPD_Day | w05220ss | - | + | - | - | - | + | + | Ref JA-SiS-IV-06 Group Abbenseth_J JA-SiS-IV-06 P-CF3 ANiline- 19F | log_err: acqt0 not set in pulse program, result may be incorrect!, log_err: acqt0 not set in pulse program, result may be incorrect!, sref: NUCLEUS '19F' not defined for SOLVENT 'C6D6' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'C6D6' SR is set to 0.0 |
| 4 | 07:52:33 | 20260907-0731-B400_B.11-3 | 4060532 | P31_NoCPD_Day | w05220ss | - | + | - | - | - | + | + | Ref JA-SiS-IV-06 Group Abbenseth_J JA-SiS-IV-06 P-CF3 ANiline- 31P | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 4 | 07:50:49 | 20260907-0731-B400_B.11-3 | 4060531 | P31_Wide_Day | w05220ss | - | + | - | - | - | + | + | Ref JA-SiS-IV-06 Group Abbenseth_J JA-SiS-IV-06 P-CF3 ANiline- 31P{1H} | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 4 | 07:49:08 | 20260907-0731-B400_B.11-3 | 4060502 | H1_P31CPD_Day | w05220ss | - | + | - | - | - | + | + | Ref JA-SiS-IV-06 Group Abbenseth_J JA-SiS-IV-06 P-CF3 ANiline- 1H{1H} | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 4 | 07:44:55 | 20260907-0731-B400_B.11-3 | 4060501 | H1_Day16 | w05220ss | + | + | - | + | + | + | + | Ref JA-SiS-IV-06 Group Abbenseth_J JA-SiS-IV-06 P-CF3 ANiline- 1H | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 3 | 07:42:55 | 20260907-0731-B400_B.11-3 | 4050632 | P31_NoCPD_Day | w05220ss | - | + | - | - | - | + | + | Ref JA-SiS-IV-05 Group Abbenseth_J JA-SiS-IV-05 P-DNEA - 31P | sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0 |
| 3 | 07:41:08 | 20260907-0731-B400_B.11-3 | 4050631 | P31_Wide_Day | w05220ss | - | + | - | - | - | + | + | Ref JA-SiS-IV-05 Group Abbenseth_J JA-SiS-IV-05 P-DNEA - 31P{1H} | sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0 |
| 3 | 07:39:10 | 20260907-0731-B400_B.11-3 | 4050602 | H1_P31CPD_Day | w05220ss | - | + | - | - | - | + | + | Ref JA-SiS-IV-05 Group Abbenseth_J JA-SiS-IV-05 P-DNEA - 1H{1H } | |
| 3 | 07:33:28 | 20260907-0731-B400_B.11-3 | 4050601 | H1_Day16 | w05220ss | + | + | - | + | + | + | + | Ref JA-SiS-IV-05 Group Abbenseth_J JA-SiS-IV-05 P-DNEA - 1H | |
| 6 | 07:06:27 | 20260907-0647-B400_B.11-6 | 10 | H1_Quant_D1_25s_Day | d93111sd | + | + | - | + | + | + | + | Ref IL-SD-465r-C Group Larrosa_I | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 5 | 05:39:55 | 20260907-0001-B400_B.11-4 | 21 | H1_Night1024 | e02956op | - | + | - | - | - | + | + | Ref GDB-OP0565_2-13C_MeCNd3 Group De bo_G | |
| 5 | 05:26:11 | 20260907-0001-B400_B.11-4 | 20 | H1_Night128 | e02956op | + | + | - | + | + | + | + | Ref GDB-OP0565_2-1H_MeCNd3 Group De bo_G | |
| 4 | 03:59:40 | 20260907-0001-B400_B.11-4 | 11 | H1_Night1024 | e02956op | - | + | - | - | - | + | + | Ref GDB-OP0566_2-13C_MeCNd3 Group De bo_G | |
| 4 | 03:46:12 | 20260907-0001-B400_B.11-4 | 10 | H1_Night128 | e02956op | + | + | - | + | + | + | + | Ref GDB-OP0566_2-1H_MeCNd3 Group De bo_G | |
| 3 | 02:49:57 | 20260906-2221-B400_B.11-3 | 10 | C13_CPD_Night1024 | e02956op | + | + | - | + | + | + | + | Ref GDB-OP0574-13C_1k_MeCNd3 Group De bo_G | |
| 56 | 02:36:31 | 20260906-1814-B400_B.11-56 | 14 | H1_COSY_HiRes_Night | mbdxkrn2 | - | + | - | - | - | + | + | Ref GDB-RN1736 Full Char - Basic CDCl3 Group De bo_G | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 56 | 02:21:10 | 20260906-1814-B400_B.11-56 | 13 | H1_C13_HSQC_Night | mbdxkrn2 | - | + | - | - | - | + | + | Ref GDB-RN1736 Full Char - Basic CDCl3 Group De bo_G | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 56 | 01:46:01 | 20260906-1814-B400_B.11-56 | 12 | H1_C13_HMBC_Night | mbdxkrn2 | - | + | - | - | - | + | + | Ref GDB-RN1736 Full Char - Basic CDCl3 Group De bo_G | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 56 | 01:39:42 | 20260906-1814-B400_B.11-56 | 11 | H1_Night | mbdxkrn2 | + | + | - | + | + | + | + | Ref GDB-RN1736 Full Char - Basic CDCl3 Group De bo_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 6 | 01:24:20 | 20260907-0003-B400_B.11-6 | 14 | H1_C13_HSQC_Night | e02956op | - | + | - | - | - | + | + | Ref GDB-OP0573_A-HSQC_MeCNd3 Group De bo_G | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 6 | 01:10:47 | 20260907-0003-B400_B.11-6 | 13 | H1_COSY_HiRes_Night | e02956op | - | + | - | - | - | + | + | Ref GDB-OP0573_A-COSY_MeCNd3 Group De bo_G | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 6 | 00:56:31 | 20260907-0003-B400_B.11-6 | 12 | C13_CPD_Night256 | e02956op | - | + | - | - | - | + | + | Ref GDB-OP0573_13C-1H_MeCNd3 Group De bo_G | |
| 6 | 00:51:50 | 20260907-0003-B400_B.11-6 | 10 | H1_Night | e02956op | + | + | - | + | + | + | + | Ref GDB-OP0573_A-1H_MeCNd3 Group De bo_G | |
| 56 | 23:54:35 | 20260906-1814-B400_B.11-56 | 10 | C13_CPD_Night1024 | mbdxkrn2 | + | + | - | + | + | + | + | Ref GDB-RN1736 Full Char - Basic CDCl3 Group De bo_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 55 | 23:41:06 | 20260906-1813-B400_B.11-55 | 14 | H1_COSY_HiRes_Night | mbdxkrn2 | - | + | - | - | - | + | + | Ref GDB-RN1737 Full Char - Basic CDCl3 Group De bo_G | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 55 | 23:25:45 | 20260906-1813-B400_B.11-55 | 13 | H1_C13_HSQC_Night | mbdxkrn2 | - | + | - | - | - | + | + | Ref GDB-RN1737 Full Char - Basic CDCl3 Group De bo_G | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 55 | 22:49:54 | 20260906-1813-B400_B.11-55 | 12 | H1_C13_HMBC_Night | mbdxkrn2 | - | + | - | - | - | + | + | Ref GDB-RN1737 Full Char - Basic CDCl3 Group De bo_G | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 55 | 22:44:10 | 20260906-1813-B400_B.11-55 | 11 | H1_Night | mbdxkrn2 | + | + | - | + | + | + | + | Ref GDB-RN1737 Full Char - Basic CDCl3 Group De bo_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 60 | 22:38:35 | 20260906-2124-B400_B.11-60 | 12 | Si29_DEPT90_Day | b19299kh | - | + | - | - | - | + | + | Ref STL-XLD-reaction 1-I2+K2C4TMS in heptane and toluene-mother liquor Group Liddle_S | sref: NUCLEUS '29Si' not defined for SOLVENT 'C6D6' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Liddle_S/data/b19299kh/nmr/20260906-2124-B400_B.11-60/12/pdata/1/peaks!, sref: NUCLEUS '29Si' not defined for SOLVENT 'C6D6' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Liddle_S/data/b19299kh/nmr/20260906-2124-B400_B.11-60/12/pdata/1/peaks! |
| 60 | 22:24:16 | 20260906-2124-B400_B.11-60 | 11 | C13_CPD_Night256 | b19299kh | - | + | - | - | - | + | + | Ref STL-XLD-reaction 1-I2+K2C4TMS in heptane and toluene-mother liquor Group Liddle_S | |
| 60 | 22:10:14 | 20260906-2124-B400_B.11-60 | 10 | H1_Night128 | b19299kh | + | + | - | + | + | + | + | Ref STL-XLD-reaction 1-I2+K2C4TMS in heptane and toluene-mother liquor Group Liddle_S | |
| 58 | 21:55:58 | 20260906-2039-B400_B.11-57 | 21 | C13_CPD_Night256 | x06125gb | - | + | - | - | - | + | + | Ref GCGBLynF2 Group Crisenza_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 58 | 21:42:27 | 20260906-2039-B400_B.11-57 | 20 | H1_Night128 | x06125gb | + | + | - | + | + | + | + | Ref GCGBLynF2 Group Crisenza_G | |
| 57 | 21:28:11 | 20260906-2039-B400_B.11-57 | 11 | C13_CPD_Night256 | x06125gb | - | + | - | - | - | + | + | Ref GCGBLynF1 Group Crisenza_G | |
| 57 | 21:13:25 | 20260906-2039-B400_B.11-57 | 10 | H1_Night128 | x06125gb | + | + | - | + | + | + | + | Ref GCGBLynF1 Group Crisenza_G | |
| 55 | 20:16:07 | 20260906-1813-B400_B.11-55 | 10 | C13_CPD_Night1024 | mbdxkrn2 | + | + | - | + | + | + | + | Ref GDB-RN1737 Full Char - Basic CDCl3 Group De bo_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 1 | 20:10:40 | 20260906-1929-B400_B.11-1 | 10 | H1_Night | x06125gb | + | + | - | + | + | + | + | Ref GCGB51321-46 Group Crisenza_G | |
| 60 | 20:04:52 | 20260906-1928-B400_B.11-59 | 20 | H1_Night | x06125gb | + | + | - | + | + | + | + | Ref GCGB51311-20 Group Crisenza_G | |
| 59 | 19:59:11 | 20260906-1928-B400_B.11-59 | 10 | H1_Night | x06125gb | + | + | - | + | + | + | + | Ref GCGB5136-10 Group Crisenza_G | |
| 58 | 19:24:03 | 20260906-1714-B400_B.11-58 | 14 | H1_C13_HMBC_Night | j83970qc | - | + | - | - | - | + | + | Ref qc-167-1 full Group De bo_G | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 58 | 19:08:41 | 20260906-1714-B400_B.11-58 | 13 | H1_C13_HSQC_Night | j83970qc | - | + | - | - | - | + | + | Ref qc-167-1 full Group De bo_G | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 58 | 18:55:13 | 20260906-1714-B400_B.11-58 | 12 | H1_COSY_HiRes_Night | j83970qc | - | + | - | - | - | + | + | Ref qc-167-1 full Group De bo_G | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 58 | 18:40:57 | 20260906-1714-B400_B.11-58 | 11 | C13_CPD_Night256 | j83970qc | - | + | - | - | - | + | + | Ref qc-167-1 full Group De bo_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 58 | 18:36:18 | 20260906-1714-B400_B.11-58 | 10 | H1_Night | j83970qc | + | + | - | + | + | + | + | Ref qc-167-1 full Group De bo_G | |
| 57 | 18:31:48 | 20260906-1605-B400_B.11-57 | 10 | H1_Day16 | mbdxkrn2 | + | + | - | + | + | + | + | Ref GDB-RN 3-azidopropan-1-ol crude - Basic CDCl3 Group De bo_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 52 | 17:56:39 | 20260906-1557-B400_B.11-52 | 14 | H1_C13_HMBC_Night | y52364mw | - | + | - | - | - | + | + | Ref GDB-MJ-D16-FULL Group De bo_G | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 52 | 17:41:18 | 20260906-1557-B400_B.11-52 | 13 | H1_C13_HSQC_Night | y52364mw | - | + | - | - | - | + | + | Ref GDB-MJ-D16-FULL Group De bo_G | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 52 | 17:25:13 | 20260906-1557-B400_B.11-52 | 12 | H1_COSY_HiRes_Night | y52364mw | + | + | - | + | + | + | + | Ref GDB-MJ-D16-FULL Group De bo_G | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 56 | 17:20:09 | 20260906-1713-B400_B.11-56 | 10 | H1_Night | y52364mw | + | + | - | + | + | + | + | Ref GDB-MJ-D17 Group De bo_G | |
| 55 | 17:14:42 | 20260906-1659-B400_B.11-55 | 10 | H1_Night | mbdxkrn2 | + | + | - | + | + | + | + | Ref GDB-RN1737 Column Main Band - Basic CDCl3 Group De bo_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 52 | 16:18:58 | 20260906-1557-B400_B.11-52 | 11 | C13_CPD_Night1024 | y52364mw | + | + | - | + | + | + | + | Ref GDB-MJ-D16-FULL Group De bo_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 56 | 16:12:21 | 20260906-1605-B400_B.11-56 | 10 | H1_Night | mbdxkrn2 | + | + | - | + | + | + | + | Ref GDB-RN Methyl 4-azidobutanoate crude - Basic CDCl3 Group De bo_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 55 | 16:06:52 | 20260906-1603-B400_B.11-55 | 10 | H1_Night | mbdxkrn2 | + | + | - | + | + | + | + | Ref GDB-RN1736 Column Fractions 21-27 - Basic CDCl3 Group De bo_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 52 | 16:02:21 | 20260906-1557-B400_B.11-52 | 10 | H1_Night | y52364mw | + | + | - | + | + | + | + | Ref GDB-MJ-D16-FULL Group De bo_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 13 | 16:00:18 | 20260906-1555-B400_B.11-13 | 11 | F19_NoCPD_Day | a44936mc | - | + | - | - | - | + | + | Ref mc-156-pf6 Group Leigh_D | log_err: acqt0 not set in pulse program, result may be incorrect!, log_err: acqt0 not set in pulse program, result may be incorrect!, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0 |
| 13 | 15:55:25 | 20260906-1555-B400_B.11-13 | 10 | H1_Day | a44936mc | + | + | - | + | + | + | + | Ref mc-156-pf6 Group Leigh_D | |
| 12 | 15:42:43 | 20260906-1541-B400_B.11-12 | 10 | F19_NoCPD_Day | a44936mc | + | + | - | + | x | + | + | Ref mc-156-naoh-f19 Group Leigh_D | topshim: TopshimPerformShimming - too many points lost during fit, Shim failed, log_err: acqt0 not set in pulse program, result may be incorrect!, log_err: acqt0 not set in pulse program, result may be incorrect!, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0 |
| 7 | 15:12:47 | 20260906-1441-B400_B.11-7 | 10 | H1_Day | a44936mc | + | + | - | + | + | + | + | Ref mc-156-naoh Group Leigh_D | |
| 11 | 15:07:00 | 20260906-1445-B400_B.11-8 | 40 | H1_Day16 | x06125gb | + | + | - | + | + | + | + | Ref GCGB50946-52 Group Crisenza_G | |
| 10 | 15:01:52 | 20260906-1445-B400_B.11-8 | 30 | H1_Day16 | x06125gb | + | + | - | + | + | + | + | Ref GCGB50928-41 Group Crisenza_G | |
| 9 | 14:56:25 | 20260906-1445-B400_B.11-8 | 20 | H1_Day16 | x06125gb | + | + | - | + | + | + | + | Ref GCGB509FlushEtOAc Group Crisenza_G | |
| 8 | 14:51:25 | 20260906-1445-B400_B.11-8 | 10 | H1_Day16 | x06125gb | + | + | - | + | + | + | + | Ref GCGBPhAcAttempt2 Group Crisenza_G | |
| 6 | 14:46:14 | 20260906-1441-B400_B.11-6 | 10 | H1_Day | a44936mc | + | + | - | + | + | + | + | Ref mc-156-pf6 Group Leigh_D | |
| 5 | 14:41:33 | 20260906-1440-B400_B.11-5 | 10 | H1_Day | a44936mc | + | + | - | + | + | + | + | Ref mc-157-reac-mix Group Leigh_D | |
| 4 | 13:59:29 | 20260906-1230-B400_B.11-4 | 16 | H1_NOESY_Night | p07890rp | - | + | - | - | - | + | + | Ref GDB-RP-108-FC-A Group De bo_G | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 4 | 13:24:21 | 20260906-1230-B400_B.11-4 | 15 | H1_C13_HMBC_Night | p07890rp | - | + | - | - | - | + | + | Ref GDB-RP-108-FC-A Group De bo_G | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 4 | 13:08:59 | 20260906-1230-B400_B.11-4 | 14 | H1_C13_HSQC_Night | p07890rp | - | + | - | - | - | + | + | Ref GDB-RP-108-FC-A Group De bo_G | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 4 | 13:06:41 | 20260906-1230-B400_B.11-4 | 13 | H1_Night | p07890rp | - | + | - | - | - | + | + | Ref GDB-RP-108-FC-A Group De bo_G | |
| 4 | 12:52:25 | 20260906-1230-B400_B.11-4 | 12 | C13_CPD_Night256 | p07890rp | - | + | - | - | - | + | + | Ref GDB-RP-108-FC-A Group De bo_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 4 | 12:46:35 | 20260906-1230-B400_B.11-4 | 11 | H1_COSY_Day | p07890rp | - | + | - | - | - | + | + | Ref GDB-RP-108-FC-A Group De bo_G | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 4 | 12:39:37 | 20260906-1230-B400_B.11-4 | 10 | H1_Day | p07890rp | + | + | - | + | + | + | + | Ref GDB-RP-108-FC-A Group De bo_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 1 | 12:33:47 | 20260906-1228-B400_B.11-1 | 11 | H1_COSY_Day | p07890rp | - | + | - | - | - | + | + | Ref GDB-RP-113-0 Group De bo_G | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 1 | 12:30:14 | 20260906-1228-B400_B.11-1 | 10 | H1_Day | p07890rp | + | + | - | + | + | + | + | Ref GDB-RP-113-0 Group De bo_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 37 | 11:18:19 | 20260906-1059-B400_B.11-36 | 20 | H1_Day16 | x06125gb | + | + | - | + | + | + | + | Ref GCGBBiotin1-8-19-27 Group Crisenza_G | |
| 36 | 11:12:40 | 20260906-1059-B400_B.11-36 | 10 | H1_Day16 | x06125gb | + | + | - | + | + | + | + | Ref GCGBBiotin9-10-17-18 Group Crisenza_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 35 | 11:07:12 | 20260906-1058-B400_B.11-34 | 20 | H1_Day16 | x06125gb | + | + | - | + | + | + | + | Ref GCGB50942-4558-flush Group Crisenza_G | |
| 34 | 11:01:49 | 20260906-1058-B400_B.11-34 | 10 | H1_Day16 | x06125gb | + | + | - | + | + | + | + | Ref GCGB50921-26 Group Crisenza_G | |
| 41 | 00:21:51 | 20260905-1941-B400_B.11-41 | 10 | H1_Day16 | z92209cg | + | + | - | + | + | + | + | Ref GCK-011-C6 Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 47 | 23:46:42 | 20260905-1909-B400_B.11-46 | 24 | H1_C13_HMBC_Night | v73981ac | - | + | - | - | - | + | + | Ref IL-AC-ANG-02-F1 Group Larrosa_I | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 47 | 23:31:20 | 20260905-1909-B400_B.11-46 | 23 | H1_C13_HSQC_Night | v73981ac | - | + | - | - | - | + | + | Ref IL-AC-ANG-02-F1 Group Larrosa_I | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 47 | 23:17:48 | 20260905-1909-B400_B.11-46 | 22 | H1_COSY_HiRes_Night | v73981ac | - | + | - | - | - | + | + | Ref IL-AC-ANG-02-F1 Group Larrosa_I | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 47 | 22:24:02 | 20260905-1909-B400_B.11-46 | 21 | C13_CPD_Night1024 | v73981ac | - | + | - | - | - | + | + | Ref IL-AC-ANG-02-F1 Group Larrosa_I | |
| 47 | 22:18:40 | 20260905-1909-B400_B.11-46 | 20 | H1_Night | v73981ac | + | + | - | + | + | + | + | Ref IL-AC-ANG-02-F1 Group Larrosa_I | |
| 46 | 21:43:31 | 20260905-1909-B400_B.11-46 | 14 | H1_C13_HMBC_Night | v73981ac | - | + | - | - | - | + | + | Ref IL-AC-ANG-02-F2 Group Larrosa_I | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 46 | 21:28:08 | 20260905-1909-B400_B.11-46 | 13 | H1_C13_HSQC_Night | v73981ac | - | + | - | - | - | + | + | Ref IL-AC-ANG-02-F2 Group Larrosa_I | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 46 | 21:14:35 | 20260905-1909-B400_B.11-46 | 12 | H1_COSY_HiRes_Night | v73981ac | - | + | - | - | - | + | + | Ref IL-AC-ANG-02-F2 Group Larrosa_I | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 46 | 20:19:57 | 20260905-1909-B400_B.11-46 | 11 | C13_CPD_Night1024 | v73981ac | - | + | - | - | - | + | + | Ref IL-AC-ANG-02-F2 Group Larrosa_I | |
| 46 | 20:14:54 | 20260905-1909-B400_B.11-46 | 10 | H1_Night | v73981ac | + | + | - | + | + | + | + | Ref IL-AC-ANG-02-F2 Group Larrosa_I | |
| 45 | 20:10:07 | 20260905-1907-B400_B.11-45 | 10 | H1_Day | k04094yj | + | + | - | + | + | + | + | Ref VJ0453-new thread rot crude Group Leigh_D | |
| 44 | 20:05:14 | 20260905-1907-B400_B.11-44 | 10 | H1_Day | k04094yj | + | + | - | + | + | + | + | Ref VJ0452-n=11 crude Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 40 | 20:01:21 | 20260905-1904-B400_B.11-40 | 10 | H1_Day | k04094yj | + | + | - | + | + | + | + | Ref VJ0449-Dep DMSO Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 39 | 19:56:08 | 20260905-1904-B400_B.11-39 | 10 | H1_Day | k04094yj | + | + | - | + | + | + | + | Ref VJ0448-25-33 Group Leigh_D | |
| 60 | 19:48:08 | 20260905-1553-B400_B.11-60 | 12 | Si29_DEPT90_Day | b19299kh | + | + | - | + | + | + | + | Ref STL-XLD-Br2-tol washings-SCXRDed Group Liddle_S | sref: NUCLEUS '29Si' not defined for SOLVENT 'C6D6' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Liddle_S/data/b19299kh/nmr/20260905-1553-B400_B.11-60/12/pdata/1/peaks!, sref: NUCLEUS '29Si' not defined for SOLVENT 'C6D6' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Liddle_S/data/b19299kh/nmr/20260905-1553-B400_B.11-60/12/pdata/1/peaks! |
| 38 | 19:32:46 | 20260905-1903-B400_B.11-38 | 12 | H1_C13_HSQC_Night | k04094yj | - | + | - | - | - | + | + | Ref VJ0447-Thread full char Group Leigh_D | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 38 | 19:17:49 | 20260905-1903-B400_B.11-38 | 11 | C13_CPD_Night256 | k04094yj | - | + | - | - | - | + | + | Ref VJ0447-Thread full char Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 38 | 19:11:56 | 20260905-1903-B400_B.11-38 | 10 | H1_Night | k04094yj | + | + | - | + | + | + | + | Ref VJ0447-Thread full char Group Leigh_D | |
| 59 | 19:04:29 | 20260905-1551-B400_B.11-59 | 12 | Si29_DEPT90_Day | b19299kh | + | + | - | + | + | + | + | Ref STL-XLD_I2+K2C4TMS in heptane and toluene-filtrated mother liquor Group Liddle_S | sref: NUCLEUS '29Si' not defined for SOLVENT 'C6D6' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Liddle_S/data/b19299kh/nmr/20260905-1551-B400_B.11-59/12/pdata/1/peaks!, sref: NUCLEUS '29Si' not defined for SOLVENT 'C6D6' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Liddle_S/data/b19299kh/nmr/20260905-1551-B400_B.11-59/12/pdata/1/peaks! |
| 37 | 18:59:52 | 20260905-1711-B400_B.11-37 | 10 | H1_Day | u67812sg | + | + | - | + | + | + | + | Ref sq-2-79-4 Group Procter_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 36 | 18:55:54 | 20260905-1711-B400_B.11-36 | 10 | H1_Day | u67812sg | + | + | - | + | + | + | + | Ref sq-2-79-3 Group Procter_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 35 | 18:51:12 | 20260905-1710-B400_B.11-35 | 10 | H1_Day | u67812sg | + | + | - | + | + | + | + | Ref sq-2-79-2 Group Procter_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 34 | 18:46:40 | 20260905-1710-B400_B.11-34 | 10 | H1_Day | u67812sg | + | + | - | + | + | + | + | Ref sq-2-79-1 Group Procter_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 29 | 18:41:04 | 20260905-1228-B400_B.11-29 | 10 | H1_Day16 | z92209cg | + | + | - | + | x | + | + | Ref GCK-010-C6-F Group Leigh_D | topshim: TopshimPerformShimming - too many points lost during fit, Shim failed, sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 28 | 18:03:03 | 20260905-1203-B400_B.11-28 | 14 | H1_C13_HMBC_Night | u67812sg | + | + | - | + | + | + | + | Ref sq-2-77-2-0905 Group Procter_D | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 30 | 17:57:05 | 20260905-1734-B400_B.11-30 | 10 | H1_Night | e72206ov | + | + | - | + | + | + | + | Ref ov-A-007-m Group De bo_G | |
| 60 | 17:39:51 | 20260905-1553-B400_B.11-60 | 11 | C13_CPD_Night256 | b19299kh | + | + | - | + | + | + | + | Ref STL-XLD-Br2-tol washings-SCXRDed Group Liddle_S | |
| 28 | 17:24:30 | 20260905-1203-B400_B.11-28 | 13 | H1_C13_HSQC_Night | u67812sg | - | + | - | - | - | + | + | Ref sq-2-77-2-0905 Group Procter_D | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 28 | 17:10:59 | 20260905-1203-B400_B.11-28 | 12 | H1_COSY_HiRes_Night | u67812sg | - | + | - | - | - | + | + | Ref sq-2-77-2-0905 Group Procter_D | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 28 | 16:56:43 | 20260905-1203-B400_B.11-28 | 11 | C13_CPD_Night256 | u67812sg | - | + | - | - | - | + | + | Ref sq-2-77-2-0905 Group Procter_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 28 | 16:50:48 | 20260905-1203-B400_B.11-28 | 10 | H1_Night | u67812sg | + | + | - | + | + | + | + | Ref sq-2-77-2-0905 Group Procter_D | |
| 60 | 16:36:34 | 20260905-1553-B400_B.11-60 | 10 | H1_Night128 | b19299kh | + | + | - | + | + | + | + | Ref STL-XLD-Br2-tol washings-SCXRDed Group Liddle_S | |
| 59 | 16:22:19 | 20260905-1551-B400_B.11-59 | 11 | C13_CPD_Night256 | b19299kh | - | + | - | - | - | + | + | Ref STL-XLD_I2+K2C4TMS in heptane and toluene-filtrated mother liquor Group Liddle_S | |
| 59 | 16:08:20 | 20260905-1551-B400_B.11-59 | 10 | H1_Night128 | b19299kh | + | + | - | + | + | + | + | Ref STL-XLD_I2+K2C4TMS in heptane and toluene-filtrated mother liquor Group Liddle_S | |
| 27 | 15:33:29 | 20260904-2039-B400_B.11-27 | 17 | H1_C13_HMBC_US_Night | j82494jb | - | + | - | - | - | + | + | Ref QBB-G158-C2F7 Group Leigh_D | |
| 27 | 15:18:15 | 20260904-2039-B400_B.11-27 | 16 | H1_C13_HSQC_US_Night | z92209cg | - | + | - | - | - | + | + | Ref QBB-G158-C2F7 Group Leigh_D | |
| 27 | 14:18:57 | 20260904-2039-B400_B.11-27 | 14 | C13_CPD_Night1024 | z92209cg | + | + | - | + | + | + | + | Ref QBB-G158-C2F7 Group Leigh_D | |
| 30 | 14:05:22 | 20260905-1322-B400_B.11-30 | 10 | H1_Night128 | mbdxkrn2 | + | + | - | + | + | + | + | Ref GDB-RN1735-1 MeOH-precipitated polymer after 1st reaction - Basic CDCl3 Group De bo_G | |
| 27 | 11:29:20 | 20260904-2039-B400_B.11-27 | 13 | H1_COSY_NS64_Night | z92209cg | - | + | - | - | - | + | x | Ref QBB-G158-C2F7 Group Leigh_D | calcphhomo: phase correction aborted magnitude or undefined data, calcphhomo: phase correction aborted magnitude or undefined data |
| 27 | 11:22:20 | 20260904-2039-B400_B.11-27 | 12 | H1_Night | z92209cg | + | + | - | + | + | + | + | Ref QBB-G158-C2F7 Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 57 | 10:51:20 | 20260905-1050-B400_B.11-57 | 10 | H1_Night128 | b19299kh | + | + | - | + | + | + | + | Ref STL-XLD_Br2-1 drop dthf-rerun Group Liddle_S | |
| 60 | 23:25:44 | 20260904-1817-B400_B.11-60 | 12 | Si29_DEPT90_Day | b19299kh | + | + | - | + | + | + | + | Ref STL-XLD-I2+Na2C4TMS in heptane-washings-neat C6D6 Group Liddle_S | sref: NUCLEUS '29Si' not defined for SOLVENT 'C6D6' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Liddle_S/data/b19299kh/nmr/20260904-1817-B400_B.11-60/12/pdata/1/peaks!, sref: NUCLEUS '29Si' not defined for SOLVENT 'C6D6' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Liddle_S/data/b19299kh/nmr/20260904-1817-B400_B.11-60/12/pdata/1/peaks! |
| 59 | 23:20:00 | 20260904-2147-B400_B.11-59 | 12 | Si29_DEPT90_Day | b19299kh | - | + | - | - | - | + | + | Ref STL-XLD-K2C4TMS-neat C6D6-new batch Group Liddle_S | sref: NUCLEUS '29Si' not defined for SOLVENT 'C6D6' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Liddle_S/data/b19299kh/nmr/20260904-2147-B400_B.11-59/12/pdata/1/peaks!, sref: NUCLEUS '29Si' not defined for SOLVENT 'C6D6' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Liddle_S/data/b19299kh/nmr/20260904-2147-B400_B.11-59/12/pdata/1/peaks! |
| 59 | 23:05:44 | 20260904-2147-B400_B.11-59 | 11 | C13_CPD_Night256 | b19299kh | - | + | - | - | - | + | + | Ref STL-XLD-K2C4TMS-neat C6D6-new batch Group Liddle_S | |
| 59 | 22:51:59 | 20260904-2147-B400_B.11-59 | 10 | H1_Night128 | b19299kh | + | + | - | + | + | + | + | Ref STL-XLD-K2C4TMS-neat C6D6-new batch Group Liddle_S | |
| 58 | 22:37:33 | 20260904-2145-B400_B.11-58 | 11 | C13_CPD_Night256 | b19299kh | - | + | - | - | - | + | + | Ref STL-XLD-Br2-one drop of dthf-2nd cycle Group Liddle_S | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 58 | 22:21:53 | 20260904-2145-B400_B.11-58 | 10 | H1_Night128 | b19299kh | + | + | - | + | + | + | + | Ref STL-XLD-Br2-one drop of dthf-2nd cycle Group Liddle_S | |
| 24 | 21:28:08 | 20260904-1808-B400_B.11-24 | 11 | C13_CPD_Night1024 | v73981ac | - | + | - | - | - | + | + | Ref IL-AC-ANG-20 Group Larrosa_I | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 24 | 21:22:19 | 20260904-1808-B400_B.11-24 | 10 | H1_Day16 | v73981ac | + | + | - | + | + | + | + | Ref IL-AC-ANG-20 Group Larrosa_I | |
| 22 | 20:52:02 | 20260904-1754-B400_B.11-22 | 12 | C13_DEPT135_Night | z88883sp | + | + | - | + | + | + | + | Ref SP438g Group Romanov_A More conc | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 27 | 20:45:44 | 20260904-2039-B400_B.11-27 | 10 | H1_Day | j82494jb | + | + | - | + | + | + | + | Ref QBB-G158-C2F7 Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 22 | 19:51:57 | 20260904-1754-B400_B.11-22 | 11 | C13_CPD_Night1024 | z88883sp | - | + | - | - | - | + | + | Ref SP438g Group Romanov_A More conc | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 22 | 19:37:04 | 20260904-1754-B400_B.11-22 | 10 | H1_Night128 | z88883sp | + | + | - | + | + | + | + | Ref SP438g Group Romanov_A More conc | |
| 20 | 19:01:55 | 20260904-1535-B400_B.11-20 | 12 | H1_C13_HMBC_Night | x06125gb | - | + | - | - | - | + | + | Ref GCGB517F8-9 Group Crisenza_G | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 20 | 18:55:56 | 20260904-1535-B400_B.11-20 | 11 | H1_Night | x06125gb | + | + | - | + | + | + | + | Ref GCGB517F8-9 Group Crisenza_G | |
| 60 | 18:41:41 | 20260904-1817-B400_B.11-60 | 11 | C13_CPD_Night256 | b19299kh | - | + | - | - | - | + | + | Ref STL-XLD-I2+Na2C4TMS in heptane-washings-neat C6D6 Group Liddle_S | |
| 60 | 18:27:50 | 20260904-1817-B400_B.11-60 | 10 | H1_Night128 | b19299kh | + | + | - | + | + | + | + | Ref STL-XLD-I2+Na2C4TMS in heptane-washings-neat C6D6 Group Liddle_S | |
| 20 | 17:30:12 | 20260904-1535-B400_B.11-20 | 10 | C13_CPD_Night1024 | x06125gb | + | + | - | + | + | + | + | Ref GCGB517F8-9 Group Crisenza_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 3 | 16:06:40 | 20260904-1601-B400_B.11-3 | 11 | B11_NoCPD_Day | n29715ss | - | + | - | - | - | + | + | Ref DJP-SS-BcatcatalyticsaltMeOH Group Procter_D | log_err: acqt0 not set in pulse program, result may be incorrect!, log_err: acqt0 not set in pulse program, result may be incorrect!, sref: NUCLEUS '11B' not defined for SOLVENT 'CDCl3' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Procter_D/data/n29715ss/nmr/20260904-1601-B400_B.11-3/11/pdata/1/peaks!, sref: NUCLEUS '11B' not defined for SOLVENT 'CDCl3' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Procter_D/data/n29715ss/nmr/20260904-1601-B400_B.11-3/11/pdata/1/peaks! |
| 3 | 16:01:50 | 20260904-1601-B400_B.11-3 | 10 | H1_Day16 | n29715ss | + | + | - | + | + | + | + | Ref DJP-SS-BcatcatalyticsaltMeOH Group Procter_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 26 | 15:16:18 | 20260904-1502-B400_B.11-26 | 12 | C13_CPD_Night256 | p10102hz | - | + | - | - | - | + | + | Ref jdr-7 Group Procter_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 26 | 15:14:23 | 20260904-1502-B400_B.11-26 | 11 | C13_CPD_Day | p10102hz | - | + | - | - | - | + | + | Ref jdr-7 Group Procter_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 26 | 15:09:17 | 20260904-1502-B400_B.11-26 | 10 | H1_Day16 | p10102hz | + | + | - | + | + | + | + | Ref jdr-7 Group Procter_D | |
| 24 | 14:51:32 | 20260904-1417-B400_B.11-24 | 11 | C13_CPD_Night256 | z16689fe | + | + | - | + | + | + | + | Ref DJP TL 070 DOT3 Group Procter_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 20 | 14:32:47 | 20260904-1339-B400_B.11-20 | 13 | H1_C13_HSQC_Night | x06125gb | + | + | - | + | + | + | + | Ref GCGB517F8-9 Group Crisenza_G | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 24 | 14:28:46 | 20260904-1417-B400_B.11-24 | 10 | H1_Day | z16689fe | + | + | - | + | + | + | + | Ref DJP TL 070 DOT3 Group Procter_D | |
| 22 | 14:26:51 | 20260904-1416-B400_B.11-22 | 11 | C13_CPD_Day | z16689fe | - | + | - | - | - | + | + | Ref DJP TL 070 DOT1 Group Procter_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 22 | 14:22:08 | 20260904-1416-B400_B.11-22 | 10 | H1_Day | z16689fe | + | + | - | + | + | + | + | Ref DJP TL 070 DOT1 Group Procter_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 20 | 14:08:39 | 20260904-1339-B400_B.11-20 | 12 | H1_COSY_HiRes_Night | x06125gb | - | + | - | - | - | + | + | Ref GCGB517F8-9 Group Crisenza_G | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 20 | 13:50:58 | 20260904-1339-B400_B.11-20 | 11 | C13_CPD_Night256 | x06125gb | + | + | - | + | + | + | + | Ref GCGB517F8-9 Group Crisenza_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 22 | 13:49:45 | 20260904-1343-B400_B.11-22 | 11 | H1_Day | c37930an | - | + | - | - | - | + | + | Ref STL-AN-060A Group Liddle_S STL-AN-0060A_cenbo3 | |
| 22 | 13:46:16 | 20260904-1343-B400_B.11-22 | 10 | H1_Wide_Day | c37930an | + | + | - | + | + | + | + | Ref STL-AN-060A Group Liddle_S STL-AN-0060A_cenbo3 | |
| 20 | 13:40:05 | 20260904-1339-B400_B.11-20 | 10 | H1_Night | x06125gb | + | + | - | + | + | + | + | Ref GCGB517F8-9 Group Crisenza_G | |
| 19 | 13:32:44 | 20260904-1319-B400_B.11-19 | 12 | C13_CPD_Day | z40973rs | - | + | - | - | - | + | + | Ref gdb-rs-316 crude Group De bo_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 19 | 13:26:52 | 20260904-1319-B400_B.11-19 | 11 | H1_COSY_Day | z40973rs | - | + | - | - | - | + | + | Ref gdb-rs-316 crude Group De bo_G | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 19 | 13:22:05 | 20260904-1319-B400_B.11-19 | 10 | H1_Day16 | z40973rs | + | + | - | + | + | + | + | Ref gdb-rs-316 crude Group De bo_G | |
| 18 | 13:20:20 | 20260904-1304-B400_B.11-18 | 11 | P31_CPD_Day | a58114lt | - | + | - | - | - | + | + | Ref b2p5-24-down Group Leigh_D | sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0; pp: Cannot find any peak for scaling in /mnt/nmrdata/Leigh_D/data/a58114lt/nmr/20260904-1304-B400_B.11-18/11/pdata/1/peaks!, sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0; pp: Cannot find any peak for scaling in /mnt/nmrdata/Leigh_D/data/a58114lt/nmr/20260904-1304-B400_B.11-18/11/pdata/1/peaks! |
| 18 | 13:14:14 | 20260904-1304-B400_B.11-18 | 10 | H1_Day16 | a58114lt | + | + | - | + | + | + | + | Ref b2p5-24-down Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 17 | 13:11:47 | 20260904-1304-B400_B.11-17 | 11 | P31_CPD_Day | a58114lt | - | + | - | - | - | + | + | Ref b2p5-24-mid Group Leigh_D | sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0; pp: Cannot find any peak for scaling in /mnt/nmrdata/Leigh_D/data/a58114lt/nmr/20260904-1304-B400_B.11-17/11/pdata/1/peaks!, sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0; pp: Cannot find any peak for scaling in /mnt/nmrdata/Leigh_D/data/a58114lt/nmr/20260904-1304-B400_B.11-17/11/pdata/1/peaks! |
| 17 | 13:06:21 | 20260904-1304-B400_B.11-17 | 10 | H1_Day16 | a58114lt | + | + | - | + | + | + | + | Ref b2p5-24-mid Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 18 | 12:30:47 | 20260904-1224-B400_B.11-17 | 20 | H1_Day16 | x06125gb | + | + | - | + | + | + | + | Ref GCGB517C2F3-7 Group Crisenza_G | |
| 17 | 12:26:03 | 20260904-1224-B400_B.11-17 | 10 | H1_Day16 | x06125gb | + | + | - | + | + | + | + | Ref GCGB517C2F8-9 Group Crisenza_G | |
| 16 | 12:07:56 | 20260904-1203-B400_B.11-16 | 10 | H1_Day | z88883sp | + | + | - | + | + | + | + | Ref SP440g Group Romanov_A | |
| 15 | 12:03:30 | 20260904-1202-B400_B.11-15 | 10 | H1_Day | z88883sp | + | + | - | + | + | + | + | Ref SP438g Group Romanov_A More conc | |
| 14 | 11:57:25 | 20260904-1151-B400_B.11-14 | 11 | C13_CPD_Day | p10102hz | - | + | - | - | - | + | + | Ref jdr-7 Group Procter_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 14 | 11:52:08 | 20260904-1151-B400_B.11-14 | 10 | H1_Day16 | p10102hz | + | + | - | + | + | + | + | Ref jdr-7 Group Procter_D | |
| 13 | 11:28:28 | 20260904-1124-B400_B.11-13 | 10 | H1_Day | e72206ov | + | + | - | + | + | + | + | Ref ov-021dum5, 64 h Group De bo_G | |
| 12 | 11:24:28 | 20260904-1124-B400_B.11-12 | 10 | H1_Day | e72206ov | + | + | - | + | + | + | + | Ref ov-021dum4, 64 h Group De bo_G | |
| 9 | 11:12:52 | 20260904-1111-B400_B.11-9 | 10 | H1_Day | z73513sx | + | + | - | + | + | + | + | Ref SX1-84-quenched-1H Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 11 | 10:48:13 | 20260904-1030-B400_B.11-7 | 30 | H1_Day16 | x06125gb | + | + | - | + | + | + | + | Ref GCGBLyn35-Flush Group Crisenza_G | |
| 7 | 10:42:07 | 20260904-1030-B400_B.11-7 | 10 | H1_Day16 | x06125gb | + | + | - | + | + | + | + | Ref GCGBLyn18-34 Group Crisenza_G | |
| 6 | 10:37:44 | 20260904-1030-B400_B.11-5 | 20 | H1_Day16 | x06125gb | + | + | - | + | + | + | + | Ref GCGBBiotin11-14-16 Group Crisenza_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 5 | 10:32:28 | 20260904-1030-B400_B.11-5 | 10 | H1_Day16 | x06125gb | + | + | - | + | + | + | + | Ref GCGBBiotin12-13 Group Crisenza_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 4 | 08:56:55 | 20260904-0847-B400_B.11-4 | 12 | Si29_CPD_Day | b50715cd | + | + | - | + | + | + | + | Ref Neutral COT-TIPS Group Goodwin_C Neutral COT-TIPS - C6D6 - {1H}Si | sref: NUCLEUS '29Si' not defined for SOLVENT 'C6D6' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Goodwin_C/data/b50715cd/nmr/20260904-0847-B400_B.11-4/12/pdata/1/peaks!, sref: NUCLEUS '29Si' not defined for SOLVENT 'C6D6' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Goodwin_C/data/b50715cd/nmr/20260904-0847-B400_B.11-4/12/pdata/1/peaks! |
| 4 | 08:53:54 | 20260904-0847-B400_B.11-4 | 11 | C13_CPD_Day | b50715cd | - | + | - | - | - | + | + | Ref Neutral COT-TIPS Group Goodwin_C Neutral COT-TIPS - C6D6 - 13C | |
| 4 | 08:49:08 | 20260904-0847-B400_B.11-4 | 10 | H1_Day16 | b50715cd | + | + | - | + | + | + | + | Ref Neutral COT-TIPS Group Goodwin_C Neutral COT-TIPS - C6D6 - 1H | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 28 | 01:10:49 | 20260903-1915-B400_B.11-28 | 10 | H1_Day | mbdxqms2 | + | + | - | + | + | + | + | Ref IL-MK-1-6 Group Leonori_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 27 | 01:07:41 | 20260903-1914-B400_B.11-27 | 10 | H1_Day | mbdxqms2 | + | + | - | + | + | + | + | Ref IL-MK-1-4-reox Group Leonori_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 26 | 01:04:05 | 20260903-1913-B400_B.11-26 | 10 | H1_Day | mbdxqms2 | + | + | - | + | + | + | + | Ref IL-MK-1-3-reox Group Leonori_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 10 | 00:36:50 | 20260903-1827-B400_B.11-10 | 12 | C13_DEPT135_Night | m52750pm | - | + | - | - | - | + | + | Ref GCPM395BF3 Group Crisenza_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 10 | 00:22:35 | 20260903-1827-B400_B.11-10 | 11 | C13_CPD_Night256 | m52750pm | - | + | - | - | - | + | + | Ref GCPM395BF3 Group Crisenza_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 10 | 00:16:54 | 20260903-1827-B400_B.11-10 | 10 | H1_Night | m52750pm | + | + | - | + | + | + | + | Ref GCPM395BF3 Group Crisenza_G | |
| 8 | 23:49:40 | 20260903-1827-B400_B.11-8 | 12 | C13_DEPT135_Night | m52750pm | - | + | - | - | - | + | + | Ref GCPM395BF1 Group Crisenza_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 8 | 23:34:53 | 20260903-1827-B400_B.11-8 | 11 | C13_CPD_Night256 | m52750pm | - | + | - | - | - | + | + | Ref GCPM395BF1 Group Crisenza_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 8 | 23:29:18 | 20260903-1827-B400_B.11-8 | 10 | H1_Night | m52750pm | + | + | - | + | + | + | + | Ref GCPM395BF1 Group Crisenza_G | |
| 1 | 23:03:40 | 20260903-1626-B400_B.11-1 | 21 | P31_Wide_Night | p27065cs | - | + | - | - | - | + | + | Ref CS_34_5 Group Goodwin_C | sref: reference peak outside file limits default calibration done, sref: reference peak outside file limits default calibration done |
| 1 | 22:37:52 | 20260903-1626-B400_B.11-1 | 20 | P31_Wide_Night | p27065cs | - | + | - | - | - | + | + | Ref CS_34_5 Group Goodwin_C | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 1 | 22:09:52 | 20260903-1626-B400_B.11-1 | 19 | P31_Wide_Night | p27065cs | + | + | - | + | + | + | + | Ref CS_34_5 Group Goodwin_C | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 38 | 22:06:50 | 20260903-2134-B400_B.11-38 | 10 | H1_Day | j45108ph | + | + | - | + | + | + | + | Ref alf-202 Group Leigh_D 03 sep | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 37 | 22:03:09 | 20260903-2134-B400_B.11-37 | 10 | H1_Day | j45108ph | + | + | - | + | + | + | + | Ref alf-197-2 Group Leigh_D 03 sep | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 36 | 21:59:52 | 20260903-2134-B400_B.11-36 | 10 | H1_Day | j45108ph | + | + | - | + | + | + | + | Ref alf-196-2 Group Leigh_D 03 sep | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 35 | 21:56:42 | 20260903-2133-B400_B.11-35 | 10 | H1_Day | j45108ph | + | + | - | + | + | + | + | Ref alf-195-2 Group Leigh_D 03 sep | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 34 | 21:51:45 | 20260903-2133-B400_B.11-34 | 10 | H1_Day | j45108ph | + | + | - | + | + | + | + | Ref alf-194 Group Leigh_D 03 sep | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 3 | 21:35:44 | 20260903-2118-B400_B.11-3 | 11 | B11_CPD_Night | n29715ss | - | + | - | - | - | + | + | Ref DJP-SS-Bct12hrstest Group Procter_D | sref: NUCLEUS '11B' not defined for SOLVENT 'CDCl3' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Procter_D/data/n29715ss/nmr/20260903-2118-B400_B.11-3/11/pdata/1/peaks!, sref: NUCLEUS '11B' not defined for SOLVENT 'CDCl3' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Procter_D/data/n29715ss/nmr/20260903-2118-B400_B.11-3/11/pdata/1/peaks! |
| 3 | 21:30:24 | 20260903-2118-B400_B.11-3 | 10 | H1_Night | n29715ss | + | + | - | + | + | + | + | Ref DJP-SS-Bct12hrstest Group Procter_D | |
| 1 | 21:05:21 | 20260903-1626-B400_B.11-1 | 18 | P31_NoCPD_Night | p27065cs | - | + | - | - | - | + | + | Ref CS_34_5 Group Goodwin_C | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 1 | 20:37:35 | 20260903-1626-B400_B.11-1 | 17 | P31_CPD_Night | p27065cs | + | + | - | + | + | + | + | Ref CS_34_5 Group Goodwin_C | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 7 | 19:40:23 | 20260903-1516-B400_B.11-7 | 11 | C13_CPD_Night1024 | u67812sg | + | + | - | + | + | + | + | Ref sq-2-76-5 Group Procter_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 6 | 18:43:25 | 20260903-1515-B400_B.11-6 | 11 | C13_CPD_Night1024 | u67812sg | + | + | - | + | + | + | + | Ref sq-2-76-4 Group Procter_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 11 | 18:38:15 | 20260903-1827-B400_B.11-11 | 10 | H1_Night | m52750pm | + | + | - | + | + | + | + | Ref GCPM395BF4 Group Crisenza_G | |
| 9 | 18:32:45 | 20260903-1827-B400_B.11-9 | 10 | H1_Night | m52750pm | + | + | - | + | + | + | + | Ref GCPM395BF2 Group Crisenza_G | |
| 3 | 18:26:46 | 20260903-1805-B400_B.11-3 | 10 | H1_Night | x06125gb | + | + | - | + | + | + | + | Ref GCGB517F51-67 Group Crisenza_G | |
| 60 | 17:30:07 | 20260903-1656-B400_B.11-60 | 11 | C13_CPD_Night1024 | b19299kh | + | + | - | + | + | + | + | Ref STL-XLD-Rb2C4TMS-one drop of dthf-C6D6 Group Liddle_S | |
| 60 | 16:57:24 | 20260903-1656-B400_B.11-60 | 10 | C13_CPD_Night256 | b19299kh | + | + | - | + | + | + | + | Ref STL-XLD-Rb2C4TMS-one drop of dthf-C6D6 Group Liddle_S | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 1 | 16:49:57 | 20260903-1626-B400_B.11-1 | 13 | H1_Night | p27065cs | + | + | - | + | + | + | + | Ref CS_34_5 Group Goodwin_C | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 4 | 16:44:32 | 20260903-1634-B400_B.11-4 | 10 | H1_Day16 | z73513sx | + | + | - | + | + | + | + | Ref SX1-83-c1f1-1H Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 3 | 16:38:13 | 20260903-1633-B400_B.11-3 | 10 | H1_Day16 | z73513sx | + | + | - | + | + | + | + | Ref SX1-81-c1f1-1H Group Leigh_D | |
| 1 | 16:36:13 | 20260903-1626-B400_B.11-1 | 12 | P31_NoCPD_Day | p27065cs | - | + | - | - | - | + | + | Ref CS_34_5 Group Goodwin_C | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 1 | 16:33:51 | 20260903-1626-B400_B.11-1 | 11 | P31_CPD_Day | p27065cs | - | + | - | - | - | + | + | Ref CS_34_5 Group Goodwin_C | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 1 | 16:29:51 | 20260903-1626-B400_B.11-1 | 10 | H1_Day16 | p27065cs | + | + | - | + | + | + | + | Ref CS_34_5 Group Goodwin_C | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 7 | 15:49:49 | 20260903-1516-B400_B.11-7 | 10 | H1_Night | u67812sg | + | + | - | + | + | + | + | Ref sq-2-76-5 Group Procter_D | |
| 6 | 15:44:20 | 20260903-1515-B400_B.11-6 | 10 | H1_Night | u67812sg | + | + | - | + | + | + | + | Ref sq-2-76-4 Group Procter_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 10 | 15:37:53 | 20260903-1535-B400_B.11-10 | 10 | H1_Day16 | h32367lm | + | + | - | + | + | + | + | Ref LM_FCat_LAH_1.5wk Group Leigh_D | |
| 9 | 15:33:05 | 20260903-1529-B400_B.11-9 | 10 | H1_Day16 | d08103sl | + | + | - | + | + | + | + | Ref sl-se-15-5-5 h Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 8 | 15:18:50 | 20260903-1511-B400_B.11-8 | 12 | C13_CPD_Night256 | p10102hz | - | + | - | - | - | + | + | Ref zhb-a-155w Group Procter_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 8 | 15:16:55 | 20260903-1511-B400_B.11-8 | 11 | C13_CPD_Day | p10102hz | - | + | - | - | - | + | + | Ref zhb-a-155w Group Procter_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 8 | 15:11:32 | 20260903-1511-B400_B.11-8 | 10 | H1_Day16 | p10102hz | + | + | - | + | + | + | + | Ref zhb-a-155w Group Procter_D | |
| 7 | 14:42:26 | 20260903-1429-B400_B.11-7 | 11 | C13_CPD_Day | u67812sg | - | + | - | - | - | + | + | Ref sq-2-76-5p Group Procter_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 7 | 14:37:21 | 20260903-1429-B400_B.11-7 | 10 | H1_Day | u67812sg | + | + | - | + | + | + | + | Ref sq-2-76-5p Group Procter_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 6 | 14:35:26 | 20260903-1428-B400_B.11-6 | 11 | C13_CPD_Day | u67812sg | - | + | - | - | - | + | + | Ref sq-2-76-4p Group Procter_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 6 | 14:30:41 | 20260903-1428-B400_B.11-6 | 10 | H1_Day | u67812sg | + | + | - | + | + | + | + | Ref sq-2-76-4p Group Procter_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 5 | 14:03:35 | 20260903-1148-B400_B.11-5 | 13 | H1_Day16 | d08103sl | + | + | - | + | + | + | + | Ref sl-se-15-5-3.5 h Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 17 | 13:26:09 | 20260903-1316-B400_B.11-17 | 10 | H1_Day16 | h32367lm | + | + | - | + | + | + | + | Ref LM_RevGelWash_DMSO Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 16 | 13:20:41 | 20260903-1313-B400_B.11-16 | 10 | H1_Day16 | h32367lm | + | + | - | + | + | + | + | Ref LM_RevGelWash_CDCl3 Group Leigh_D | |
| 15 | 13:14:29 | 20260903-1313-B400_B.11-15 | 10 | H1_Day16 | h32367lm | + | + | - | + | + | + | + | Ref LM_FCat_LAH_Clean_ext Group Leigh_D | |
| 5 | 12:39:11 | 20260903-1148-B400_B.11-5 | 12 | H1_Day16 | d08103sl | + | + | - | + | + | + | + | Ref sl-se-15-5-1 h Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 8 | 12:33:42 | 20260903-1226-B400_B.11-8 | 10 | H1_Day16 | z73513sx | + | + | - | + | + | + | + | Ref SX1-81-quenched-1H Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 7 | 12:27:51 | 20260903-1226-B400_B.11-7 | 10 | H1_Day16 | z73513sx | + | + | - | + | + | + | + | Ref SX1-79-quenched-1H Group Leigh_D | |
| 5 | 12:08:47 | 20260903-1148-B400_B.11-5 | 11 | H1_Day16 | d08103sl | + | + | - | + | + | + | + | Ref sl-se-15-5-0.5 h Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 6 | 12:04:48 | 20260903-1203-B400_B.11-6 | 10 | H1_Day16 | d08103sl | + | + | - | + | + | + | + | Ref sl-se-7 Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 5 | 11:49:56 | 20260903-1148-B400_B.11-5 | 10 | H1_Day16 | d08103sl | + | + | - | + | + | + | + | Ref sl-se-15-5-0 h Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 4 | 11:47:35 | 20260903-1135-B400_B.11-4 | 12 | C13_CPD_Day | z40973rs | - | + | - | - | - | + | + | Ref gdb-rs-314 crude Group De bo_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 4 | 11:41:42 | 20260903-1135-B400_B.11-4 | 11 | H1_COSY_Day | z40973rs | - | + | - | - | - | + | + | Ref gdb-rs-314 crude Group De bo_G | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 4 | 11:37:09 | 20260903-1135-B400_B.11-4 | 10 | H1_Day16 | z40973rs | + | + | - | + | + | + | + | Ref gdb-rs-314 crude Group De bo_G | |
| 25 | 11:31:26 | 20260903-1059-B400_B.11-25 | 10 | H1_Night | b50715cd | - | - | - | - | - | - | - | Ref Neutral COT-TIPS Group Goodwin_C 1H - C6D6 | |
| 39 | 11:28:07 | 20260903-1111-B400_B.11-39 | 10 | H1_Day | u67812sg | + | + | - | + | + | + | + | Ref sq-2-78-3 Group Procter_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 38 | 11:24:50 | 20260903-1111-B400_B.11-38 | 10 | H1_Day | u67812sg | + | + | - | + | + | + | + | Ref sq-2-78-2 Group Procter_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 37 | 11:21:26 | 20260903-1110-B400_B.11-37 | 10 | H1_Day | u67812sg | + | + | - | + | + | + | + | Ref sq-2-78-1 Group Procter_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 36 | 11:17:47 | 20260903-1102-B400_B.11-36 | 10 | H1_Day | c15276ec | + | + | - | + | + | + | + | Ref exc248-background-dic-kcl Group Leigh_D exc248-background-dic-kcl | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 35 | 11:14:11 | 20260903-1102-B400_B.11-35 | 10 | H1_Day | c15276ec | + | + | - | + | + | + | + | Ref exc248-background-dic-nacl Group Leigh_D exc248-background-dic-nacl | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 34 | 11:10:33 | 20260903-1102-B400_B.11-34 | 10 | H1_Day | c15276ec | + | + | - | + | + | + | + | Ref exc248-background-dic-nosalt Group Leigh_D exc248-background-dic-nosalt | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 24 | 11:06:47 | 20260903-1048-B400_B.11-24 | 10 | H1_Day | c15276ec | + | + | - | + | + | + | + | Ref exc252-bulky-cepump-kcl-30-14 Group Leigh_D exc252-bulky-cepump-kcl-30-14 | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 23 | 11:03:41 | 20260903-1048-B400_B.11-23 | 10 | H1_Day | c15276ec | + | + | - | x | - | - | - | Ref exc252-bulky-cepump-nacl-30-14 Group Leigh_D exc252-bulky-cepump-nacl-30-14 | Lock failed after multiple attempts, lock: Command 'lock MeOD' failed. Lock is OFF, Command 'lock MeOD' failed. Lock is OFF |
| 22 | 10:58:08 | 20260903-1048-B400_B.11-22 | 11 | H1_Day | c15276ec | + | + | - | + | + | + | + | Ref exc252-bulky-cepump-nosalt-30-14 Group Leigh_D exc252-bulky-cepump-nosalt-30-14 | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 22 | 10:49:32 | 20260903-1048-B400_B.11-22 | 10 | H1_Day | c15276ec | - | - | - | - | - | - | - | Ref exc252-bulky-cepump-nosalt-30-14 Group Leigh_D exc252-bulky-cepump-nosalt-30-14 | |
| 15 | 10:46:25 | 20260903-1036-B400_B.11-15 | 10 | H1_Day | u67812sg | x | - | - | - | - | - | - | Ref sq-2-78-3 Group Procter_D | WebService Error: 103.310.192:Insert Error:Transfer of sample '15' from Magnet (1) to Sample Changer (0) could not be performed. Reason: 117.310.199:Eject Failed:Sample is not hovering.. |
| 14 | 10:43:04 | 20260903-1036-B400_B.11-14 | 10 | H1_Day | u67812sg | + | + | - | + | + | + | + | Ref sq-2-78-2 Group Procter_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 13 | 10:39:26 | 20260903-1035-B400_B.11-13 | 10 | H1_Day | u67812sg | + | + | - | + | + | + | + | Ref sq-2-78-1 Group Procter_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 12 | 10:35:20 | 20260903-1035-B400_B.11-12 | 10 | H1_Day | mbdxqms2 | + | + | - | + | + | + | + | Ref chiral aux S Group Leonori_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 11 | 10:12:54 | 20260903-1008-B400_B.11-10 | 20 | H1_Day | mbdxqms2 | + | + | - | + | + | + | + | Ref IL-MK-1-4 Group Leonori_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 10 | 10:09:27 | 20260903-1008-B400_B.11-10 | 10 | H1_Day | mbdxqms2 | + | + | - | + | + | + | + | Ref IL-MK-1-3 Group Leonori_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 1 | 09:42:26 | 20260903-0933-B400_B.11-1 | 16 | P31_Wide_Day | p27065cs | - | + | - | - | - | + | + | Ref CS_34_4 Group Goodwin_C | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 1 | 09:40:26 | 20260903-0933-B400_B.11-1 | 13 | P31_NoCPD_Day | p27065cs | - | + | - | - | - | + | + | Ref CS_34_4 Group Goodwin_C | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 1 | 09:38:03 | 20260903-0933-B400_B.11-1 | 11 | P31_CPD_Day | p27065cs | - | + | - | - | - | + | + | Ref CS_34_4 Group Goodwin_C | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 1 | 09:34:51 | 20260903-0933-B400_B.11-1 | 10 | H1_Day | p27065cs | + | + | - | + | + | + | + | Ref CS_34_4 Group Goodwin_C | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 6 | 05:53:22 | 20260902-2222-B400_B.11-6 | 16 | H1_NOESY_US_Night | v73981ac | - | + | - | - | - | + | + | Ref IL-AC-ANG-16-isolated Group Larrosa_I | |
| 6 | 05:18:10 | 20260902-2222-B400_B.11-6 | 15 | H1_C13_HMBC_Night | v73981ac | - | + | - | - | - | + | + | Ref IL-AC-ANG-16-isolated Group Larrosa_I | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 6 | 05:02:48 | 20260902-2222-B400_B.11-6 | 14 | H1_C13_HSQC_Night | v73981ac | - | + | - | - | - | + | + | Ref IL-AC-ANG-16-isolated Group Larrosa_I | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 6 | 04:49:21 | 20260902-2222-B400_B.11-6 | 13 | H1_COSY_HiRes_Night | v73981ac | - | + | - | - | - | + | + | Ref IL-AC-ANG-16-isolated Group Larrosa_I | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 6 | 03:55:36 | 20260902-2222-B400_B.11-6 | 12 | C13_CPD_Night1024 | v73981ac | - | + | - | - | - | + | + | Ref IL-AC-ANG-16-isolated Group Larrosa_I | |
| 6 | 03:53:23 | 20260902-2222-B400_B.11-6 | 11 | H1_Night | v73981ac | - | + | - | - | - | + | + | Ref IL-AC-ANG-16-isolated Group Larrosa_I | |
| 6 | 03:48:37 | 20260902-2222-B400_B.11-6 | 10 | H1_Day16 | v73981ac | + | + | - | + | + | + | + | Ref IL-AC-ANG-16-isolated Group Larrosa_I | |
| 48 | 03:21:23 | 20260902-1906-B400_B.11-48 | 12 | C13_DEPT135_Night | m52750pm | - | + | - | - | - | + | + | Ref GCPM393F1 Group Crisenza_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 48 | 03:07:07 | 20260902-1906-B400_B.11-48 | 11 | C13_CPD_Night256 | m52750pm | - | + | - | - | - | + | + | Ref GCPM393F1 Group Crisenza_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 48 | 03:02:24 | 20260902-1906-B400_B.11-48 | 10 | H1_Night | m52750pm | + | + | - | + | + | + | + | Ref GCPM393F1 Group Crisenza_G | |
| 47 | 02:35:09 | 20260902-1906-B400_B.11-47 | 12 | C13_DEPT135_Night | m52750pm | - | + | - | - | - | + | + | Ref GCPM397cr Group Crisenza_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 47 | 02:20:05 | 20260902-1906-B400_B.11-47 | 11 | C13_CPD_Night256 | m52750pm | - | + | - | - | - | + | + | Ref GCPM397cr Group Crisenza_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 47 | 02:14:21 | 20260902-1906-B400_B.11-47 | 10 | H1_Night | m52750pm | + | + | - | + | + | + | + | Ref GCPM397cr Group Crisenza_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 45 | 01:47:17 | 20260902-1833-B400_B.11-45 | 14 | P31_CPD_Night | q50682hk | - | + | - | - | - | + | + | Ref HK-DW-10 pF lig Group Willcox_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 45 | 01:40:40 | 20260902-1833-B400_B.11-45 | 13 | F19_NoCPD_Night | q50682hk | - | + | - | - | - | + | + | Ref HK-DW-10 pF lig Group Willcox_D | log_err: acqt0 not set in pulse program, result may be incorrect!, log_err: acqt0 not set in pulse program, result may be incorrect!, sref: NUCLEUS '19F' not defined for SOLVENT 'C6D6' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'C6D6' SR is set to 0.0 |
| 45 | 01:25:03 | 20260902-1833-B400_B.11-45 | 12 | B11_NoCPD_Night | q50682hk | - | + | - | - | - | + | + | Ref HK-DW-10 pF lig Group Willcox_D | log_err: acqt0 not set in pulse program, result may be incorrect!, log_err: acqt0 not set in pulse program, result may be incorrect!, sref: NUCLEUS '11B' not defined for SOLVENT 'C6D6' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Willcox_D/data/q50682hk/nmr/20260902-1833-B400_B.11-45/12/pdata/1/peaks!, sref: NUCLEUS '11B' not defined for SOLVENT 'C6D6' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Willcox_D/data/q50682hk/nmr/20260902-1833-B400_B.11-45/12/pdata/1/peaks! |
| 45 | 01:10:46 | 20260902-1833-B400_B.11-45 | 11 | C13_CPD_Night256 | q50682hk | - | + | - | - | - | + | + | Ref HK-DW-10 pF lig Group Willcox_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 45 | 01:07:08 | 20260902-1833-B400_B.11-45 | 10 | H1_Day | q50682hk | + | + | - | + | + | + | + | Ref HK-DW-10 pF lig Group Willcox_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 42 | 00:25:53 | 20260902-1602-B400_B.11-42 | 14 | H1_C13_HMBC_Night | w83786og | + | + | - | + | + | + | + | Ref MIG-OWG003.6.1 full chrac Group Gibson_M | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 14 | 00:12:25 | 20260902-0725-B400_B.11-14 | 14 | H1_COSY_HiRes_Night | mbdxkrn2 | - | + | - | - | - | + | + | Ref GDB-RN1732 Full Char - Acetone-d6 Group De bo_G | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 14 | 23:57:04 | 20260902-0725-B400_B.11-14 | 13 | H1_C13_HSQC_Night | mbdxkrn2 | - | + | - | - | - | + | + | Ref GDB-RN1732 Full Char - Acetone-d6 Group De bo_G | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 14 | 23:21:54 | 20260902-0725-B400_B.11-14 | 12 | H1_C13_HMBC_Night | mbdxkrn2 | - | + | - | - | - | + | + | Ref GDB-RN1732 Full Char - Acetone-d6 Group De bo_G | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 14 | 23:17:29 | 20260902-0725-B400_B.11-14 | 11 | H1_Night | mbdxkrn2 | + | + | - | + | + | + | + | Ref GDB-RN1732 Full Char - Acetone-d6 Group De bo_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 5 | 23:02:07 | 20260902-1959-B400_B.11-3 | 31 | H1_C13_HSQC_Night | f11141tm | - | + | - | - | - | + | + | Ref Cu(Salen)-Sm MAO CH3CN 5% H2O 0.1M lutidine 2mA 1h Group Yang_S | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 5 | 22:48:13 | 20260902-1959-B400_B.11-3 | 30 | H1_Night128 | f11141tm | + | + | - | + | + | + | + | Ref Cu(Salen)-Sm MAO CH3CN 5% H2O 0.1M lutidine 2mA 1h Group Yang_S | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 4 | 22:32:52 | 20260902-1959-B400_B.11-3 | 21 | H1_C13_HSQC_Night | f11141tm | - | + | - | - | - | + | + | Ref Cu(Salen)-Sm MAO CH3CN 5% H2O 2mA 1h Group Yang_S | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 4 | 22:18:59 | 20260902-1959-B400_B.11-3 | 20 | H1_Night128 | f11141tm | + | + | - | + | + | + | + | Ref Cu(Salen)-Sm MAO CH3CN 5% H2O 2mA 1h Group Yang_S | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 3 | 22:03:38 | 20260902-1959-B400_B.11-3 | 11 | H1_C13_HSQC_Night | f11141tm | - | + | - | - | - | + | + | Ref Cu(Salen)-Sm MAO CH3CN 0.1M lutidine 2mA 1h Group Yang_S | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 3 | 21:49:23 | 20260902-1959-B400_B.11-3 | 10 | H1_Night128 | f11141tm | + | + | - | + | + | + | + | Ref Cu(Salen)-Sm MAO CH3CN 0.1M lutidine 2mA 1h Group Yang_S | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 14 | 20:00:21 | 20260902-0725-B400_B.11-14 | 10 | C13_CPD_Night1024 | mbdxkrn2 | + | + | - | + | + | + | + | Ref GDB-RN1732 Full Char - Acetone-d6 Group De bo_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 52 | 19:54:52 | 20260902-1907-B400_B.11-52 | 10 | H1_Night | m52750pm | + | + | - | + | + | + | + | Ref GCPM393F4 Group Crisenza_G | |
| 50 | 19:49:44 | 20260902-1906-B400_B.11-50 | 10 | H1_Night | m52750pm | + | + | - | + | + | + | + | Ref GCPM393F3 Group Crisenza_G | |
| 49 | 19:44:15 | 20260902-1906-B400_B.11-49 | 10 | H1_Night | m52750pm | + | + | - | + | + | + | + | Ref GCPM393F2 Group Crisenza_G | |
| 46 | 19:29:59 | 20260902-1906-B400_B.11-46 | 11 | C13_CPD_Night256 | m52750pm | - | + | - | - | - | + | + | Ref GCPM396F1 Group Crisenza_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 46 | 19:25:10 | 20260902-1906-B400_B.11-46 | 10 | H1_Night | m52750pm | + | + | - | + | + | + | + | Ref GCPM396F1 Group Crisenza_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 44 | 18:50:01 | 20260902-1601-B400_B.11-44 | 14 | H1_C13_HMBC_Night | w83786og | - | + | - | - | - | + | + | Ref MIG-OWG003.5 meod full charac Group Gibson_M | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 44 | 18:31:27 | 20260902-1601-B400_B.11-44 | 13 | H1_C13_HSQC_Night | w83786og | + | + | - | + | + | + | + | Ref MIG-OWG003.5 meod full charac Group Gibson_M | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 50 | 18:24:44 | 20260902-1728-B400_B.11-45 | 62 | F19_NoCPD_Night | x06125gb | - | + | - | - | - | + | + | Ref GCGBRcCy Group Crisenza_G | log_err: acqt0 not set in pulse program, result may be incorrect!, log_err: acqt0 not set in pulse program, result may be incorrect!, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0 |
| 50 | 18:10:29 | 20260902-1728-B400_B.11-45 | 61 | C13_CPD_Night256 | x06125gb | - | + | - | - | - | + | + | Ref GCGBRcCy Group Crisenza_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 50 | 17:56:56 | 20260902-1728-B400_B.11-45 | 60 | H1_Night128 | x06125gb | + | + | - | + | + | + | + | Ref GCGBRcCy Group Crisenza_G | |
| 49 | 17:51:31 | 20260902-1728-B400_B.11-45 | 50 | H1_Night | x06125gb | + | + | - | + | x | + | + | Ref GCGB517F31-50 Group Crisenza_G | topshim: TopshimPerformShimming - too many points lost during fit, Shim failed |
| 48 | 17:47:22 | 20260902-1728-B400_B.11-45 | 40 | H1_Night | x06125gb | + | + | - | + | + | + | + | Ref GCGB517F21-30 Group Crisenza_G | |
| 47 | 17:43:05 | 20260902-1728-B400_B.11-45 | 30 | H1_Night | x06125gb | + | + | - | + | + | + | + | Ref GCGB517F16-18 Group Crisenza_G | |
| 46 | 17:38:01 | 20260902-1728-B400_B.11-45 | 20 | H1_Night | x06125gb | + | + | - | + | + | + | + | Ref GCGB517F1-15 Group Crisenza_G | |
| 45 | 17:32:00 | 20260902-1728-B400_B.11-45 | 10 | H1_Night | x06125gb | + | + | - | + | + | + | + | Ref GCGBCheck Group Crisenza_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 44 | 17:18:32 | 20260902-1601-B400_B.11-44 | 12 | H1_COSY_HiRes_Night | w83786og | - | + | - | - | - | + | + | Ref MIG-OWG003.5 meod full charac Group Gibson_M | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 44 | 17:04:05 | 20260902-1601-B400_B.11-44 | 11 | C13_CPD_Night256 | w83786og | - | + | - | - | - | + | + | Ref MIG-OWG003.5 meod full charac Group Gibson_M | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 44 | 16:58:27 | 20260902-1601-B400_B.11-44 | 10 | H1_Night | w83786og | + | + | - | + | + | + | + | Ref MIG-OWG003.5 meod full charac Group Gibson_M | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 42 | 16:43:05 | 20260902-1602-B400_B.11-42 | 13 | H1_C13_HSQC_Night | w83786og | - | + | - | - | - | + | + | Ref MIG-OWG003.6.1 full chrac Group Gibson_M | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 42 | 16:26:17 | 20260902-1602-B400_B.11-42 | 12 | H1_COSY_HiRes_Night | w83786og | + | + | - | + | + | + | + | Ref MIG-OWG003.6.1 full chrac Group Gibson_M | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 43 | 16:21:40 | 20260902-1619-B400_B.11-43 | 10 | H1_Day16 | d08103sl | + | + | - | + | + | + | + | Ref sl-se-15-4-1 h Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 42 | 16:07:23 | 20260902-1602-B400_B.11-42 | 11 | C13_CPD_Night256 | w83786og | - | + | - | - | - | + | + | Ref MIG-OWG003.6.1 full chrac Group Gibson_M | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 42 | 16:02:58 | 20260902-1602-B400_B.11-42 | 10 | H1_Night | w83786og | + | + | - | + | + | + | + | Ref MIG-OWG003.6.1 full chrac Group Gibson_M | |
| 43 | 15:41:33 | 20260902-1522-B400_B.11-43 | 10 | H1_Day | j82494jb | + | + | - | + | + | + | + | Ref QBBB-G157-1hr Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 42 | 15:37:30 | 20260902-1518-B400_B.11-42 | 10 | H1_Day | w83786og | + | + | - | + | + | + | + | Ref MIG-OWG003.6.1 Group Gibson_M | |
| 41 | 15:32:05 | 20260902-1517-B400_B.11-41 | 10 | H1_Day16 | z73513sx | + | + | - | + | + | + | + | Ref SX1-80-c1f2-1H Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 40 | 15:25:28 | 20260902-1517-B400_B.11-40 | 10 | H1_Day16 | z73513sx | + | + | - | + | + | + | + | Ref SX1-80-c1f1-1H Group Leigh_D | |
| 39 | 15:20:46 | 20260902-1501-B400_B.11-39 | 10 | H1_Day16 | d08103sl | + | + | - | + | + | + | + | Ref sl-se-15-4-0 h Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 38 | 15:18:40 | 20260902-1500-B400_B.11-37 | 21 | C13_CPD_Day | p10102hz | - | + | - | - | - | + | + | Ref zhb-a-155t Group Procter_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 38 | 15:12:00 | 20260902-1500-B400_B.11-37 | 20 | H1_Day16 | p10102hz | + | + | - | + | + | + | + | Ref zhb-a-155t Group Procter_D | |
| 37 | 15:09:20 | 20260902-1500-B400_B.11-37 | 11 | C13_CPD_Day | p10102hz | - | + | - | - | - | + | + | Ref zhb-a-155u Group Procter_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 37 | 15:03:59 | 20260902-1500-B400_B.11-37 | 10 | H1_Day16 | p10102hz | + | + | - | + | + | + | + | Ref zhb-a-155u Group Procter_D | |
| 36 | 14:58:53 | 20260902-1447-B400_B.11-34 | 30 | H1_Day16 | x06125gb | + | + | - | + | + | + | + | Ref GCGB517Flush Group Crisenza_G | |
| 35 | 14:53:47 | 20260902-1447-B400_B.11-34 | 20 | H1_Day16 | x06125gb | + | + | - | + | + | + | + | Ref GCGB517F32 Group Crisenza_G | |
| 34 | 14:49:09 | 20260902-1447-B400_B.11-34 | 10 | H1_Day16 | x06125gb | + | + | - | + | + | + | + | Ref GCGB517F24 Group Crisenza_G | |
| 25 | 14:30:56 | 20260902-1430-B400_B.11-25 | 10 | H1_Day16 | d08103sl | + | + | - | + | + | + | + | Ref sl-se-15-2-4 h Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 5 | 14:04:25 | 20260902-1355-B400_B.11-5 | 11 | Si29_DEPT90_Day | mbdxrlw2 | - | + | - | - | - | + | + | Ref lw_phsime3cb_fraction13_18_crystal Group Mills_D | sref: NUCLEUS '29Si' not defined for SOLVENT 'C6D6' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Mills_D/data/mbdxrlw2/nmr/20260902-1355-B400_B.11-5/11/pdata/1/peaks!, sref: NUCLEUS '29Si' not defined for SOLVENT 'C6D6' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Mills_D/data/mbdxrlw2/nmr/20260902-1355-B400_B.11-5/11/pdata/1/peaks! |
| 5 | 14:00:14 | 20260902-1355-B400_B.11-5 | 10 | H1_Day16 | mbdxrlw2 | + | + | - | + | + | + | + | Ref lw_phsime3cb_fraction13_18_crystal Group Mills_D | |
| 4 | 13:54:52 | 20260902-1340-B400_B.11-4 | 12 | Si29_DEPT90_Day | mbdxrlw2 | - | + | - | - | - | + | + | Ref dpm_lw038_YBH4_3_THF3_transCb Group Mills_D | sref: NUCLEUS '29Si' not defined for SOLVENT 'C6D6' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Mills_D/data/mbdxrlw2/nmr/20260902-1340-B400_B.11-4/12/pdata/1/peaks!, sref: NUCLEUS '29Si' not defined for SOLVENT 'C6D6' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Mills_D/data/mbdxrlw2/nmr/20260902-1340-B400_B.11-4/12/pdata/1/peaks! |
| 4 | 13:53:14 | 20260902-1340-B400_B.11-4 | 11 | B11_CPD_Day | mbdxrlw2 | - | + | - | - | - | + | + | Ref dpm_lw038_YBH4_3_THF3_transCb Group Mills_D | sref: NUCLEUS '11B' not defined for SOLVENT 'C6D6' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Mills_D/data/mbdxrlw2/nmr/20260902-1340-B400_B.11-4/11/pdata/1/peaks!, sref: NUCLEUS '11B' not defined for SOLVENT 'C6D6' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Mills_D/data/mbdxrlw2/nmr/20260902-1340-B400_B.11-4/11/pdata/1/peaks! |
| 4 | 13:49:17 | 20260902-1340-B400_B.11-4 | 10 | H1_Day16 | mbdxrlw2 | + | + | - | + | + | + | + | Ref dpm_lw038_YBH4_3_THF3_transCb Group Mills_D | |
| 3 | 13:46:49 | 20260902-1339-B400_B.11-3 | 11 | B11_CPD_Day | mbdxrlw2 | - | + | - | - | - | + | + | Ref dpm_lw_YBH43THf3 Group Mills_D | sref: NUCLEUS '11B' not defined for SOLVENT 'C6D6' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Mills_D/data/mbdxrlw2/nmr/20260902-1339-B400_B.11-3/11/pdata/1/peaks!, sref: NUCLEUS '11B' not defined for SOLVENT 'C6D6' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Mills_D/data/mbdxrlw2/nmr/20260902-1339-B400_B.11-3/11/pdata/1/peaks! |
| 3 | 13:42:30 | 20260902-1339-B400_B.11-3 | 10 | H1_Day16 | mbdxrlw2 | + | + | - | + | + | + | + | Ref dpm_lw_YBH43THf3 Group Mills_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 3 | 13:30:08 | 20260902-1325-B400_B.11-3 | 10 | H1_Day | e72206ov | + | + | - | + | + | + | + | Ref ov-007-l Group De bo_G | |
| 1 | 13:25:38 | 20260902-1325-B400_B.11-1 | 10 | H1_Day | e72206ov | + | + | - | + | + | + | + | Ref ov-007-k Group De bo_G | |
| 12 | 13:05:22 | 20260902-1258-B400_B.11-11 | 20 | H1_Day16 | x06125gb | + | + | - | + | + | + | + | Ref GCGBLynFlush Group Crisenza_G | |
| 11 | 12:59:42 | 20260902-1258-B400_B.11-11 | 10 | H1_Day16 | x06125gb | + | + | - | + | + | + | + | Ref GCGBLynF6 Group Crisenza_G | |
| 1 | 12:19:04 | 20260902-1218-B400_B.11-1 | 10 | H1_Day16 | d08103sl | + | + | - | + | + | + | + | Ref sl-se-15-2-2 h Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 36 | 11:58:56 | 20260902-1131-B400_B.11-36 | 12 | F19_NoCPD_Day | f09303eg | - | + | - | - | - | + | + | Ref EG106 Group Webb_S | log_err: acqt0 not set in pulse program, result may be incorrect!, log_err: acqt0 not set in pulse program, result may be incorrect!, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0 |
| 36 | 11:53:05 | 20260902-1131-B400_B.11-36 | 11 | H1_COSY_Day | f09303eg | - | + | - | - | - | + | + | Ref EG106 Group Webb_S | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 36 | 11:47:51 | 20260902-1131-B400_B.11-36 | 10 | H1_Day | f09303eg | + | + | - | + | + | + | + | Ref EG106 Group Webb_S | |
| 34 | 11:30:02 | 20260901-2123-B400_B.11-34 | 11 | H1_C13_HSQC_Night | f11141tm | + | + | - | + | + | + | + | Ref Cu(Salen)-Sm AOM CH3CN 2mA 1h Group Yang_S | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 39 | 11:25:39 | 20260902-1122-B400_B.11-39 | 10 | H1_Day16 | d08103sl | + | + | - | + | + | + | + | Ref sl-se-15-3 Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 38 | 11:21:02 | 20260902-1102-B400_B.11-38 | 10 | H1_Day16 | d08103sl | + | + | - | + | + | + | + | Ref sl-se-15-2-0.5 h Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 37 | 11:16:32 | 20260902-1051-B400_B.11-36 | 20 | H1_Day16 | p13528bg | + | + | - | + | + | + | + | Ref BG-040b) prep band1 Group De bo_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 36 | 11:11:55 | 20260902-1051-B400_B.11-36 | 10 | H1_Day16 | p13528bg | + | + | - | + | + | + | + | Ref BG-061b) post extraction Group De bo_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 35 | 11:05:58 | 20260902-1049-B400_B.11-35 | 12 | Si29_DEPT90_Day | g36620hh | - | + | - | - | - | + | + | Ref HH43.1 Group Mills_D | sref: NUCLEUS '29Si' not defined for SOLVENT 'CDCl3' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Mills_D/data/g36620hh/nmr/20260902-1049-B400_B.11-35/12/pdata/1/peaks!, sref: NUCLEUS '29Si' not defined for SOLVENT 'CDCl3' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Mills_D/data/g36620hh/nmr/20260902-1049-B400_B.11-35/12/pdata/1/peaks! |
| 35 | 11:01:26 | 20260902-1049-B400_B.11-35 | 11 | C13_DEPTQ_Day | g36620hh | - | + | - | - | - | + | + | Ref HH43.1 Group Mills_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 35 | 10:57:32 | 20260902-1049-B400_B.11-35 | 10 | H1_Day | g36620hh | + | + | - | + | + | + | + | Ref HH43.1 Group Mills_D | |
| 34 | 10:43:06 | 20260901-2123-B400_B.11-34 | 10 | H1_Night128 | f11141tm | + | + | - | + | + | + | + | Ref Cu(Salen)-Sm AOM CH3CN 2mA 1h Group Yang_S | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 4 | 10:38:50 | 20260902-1033-B400_B.11-3 | 20 | H1_Day16 | d08103sl | + | + | - | + | + | + | + | Ref sl-se-15-2-0 h Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 3 | 10:34:41 | 20260902-1033-B400_B.11-3 | 10 | H1_Day16 | d08103sl | + | + | - | + | + | + | + | Ref sl-se-7 Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 15 | 09:03:16 | 20260902-0856-B400_B.11-15 | 11 | C13_CPD_Day | x06125gb | - | + | - | - | - | + | + | Ref GCGBPhAcMeOD Group Crisenza_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 15 | 08:57:55 | 20260902-0856-B400_B.11-15 | 10 | H1_Day16 | x06125gb | + | + | - | + | + | + | + | Ref GCGBPhAcMeOD Group Crisenza_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 16 | 08:33:44 | 20260902-0833-B400_B.11-16 | 10 | H1_Night | mbdxkrn2 | + | + | - | + | + | + | + | Ref GDB-RN Quinine - Basic CDCl3 Group De bo_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 5 | 08:20:34 | 20260902-0750-B400_B.11-3 | 4080332 | P31_NoCPD_Day | w05220ss | - | + | - | - | - | + | + | Ref JA-SiS-IV-08 Group Abbenseth_J JA-SiS-IV-08 P-MesNH2 - 31P | sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0 |
| 5 | 08:18:45 | 20260902-0750-B400_B.11-3 | 4080331 | P31_Wide_Day | w05220ss | - | + | - | - | - | + | + | Ref JA-SiS-IV-08 Group Abbenseth_J JA-SiS-IV-08 P-MesNH2 - 31P{1H} | sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0 |
| 5 | 08:13:01 | 20260902-0750-B400_B.11-3 | 4080301 | H1_Day16 | w05220ss | + | + | - | + | + | + | + | Ref JA-SiS-IV-08 Group Abbenseth_J JA-SiS-IV-08 P-MesNH2 - 1H | |
| 4 | 08:11:10 | 20260902-0750-B400_B.11-3 | 4060419 | F19_NoCPD_Day | w05220ss | - | + | - | - | - | + | + | Ref JA-SiS-IV-06 Group Abbenseth_J JA-SiS-IV-06 P-CF3Anilline - 19F | log_err: acqt0 not set in pulse program, result may be incorrect!, log_err: acqt0 not set in pulse program, result may be incorrect!, sref: NUCLEUS '19F' not defined for SOLVENT 'C6D6' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'C6D6' SR is set to 0.0 |
| 4 | 08:09:10 | 20260902-0750-B400_B.11-3 | 4060432 | P31_NoCPD_Day | w05220ss | - | + | - | - | - | + | + | Ref JA-SiS-IV-06 Group Abbenseth_J JA-SiS-IV-06 P-CF3Anilline - 31P | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 4 | 08:07:26 | 20260902-0750-B400_B.11-3 | 4060431 | P31_Wide_Day | w05220ss | - | + | - | - | - | + | + | Ref JA-SiS-IV-06 Group Abbenseth_J JA-SiS-IV-06 P-CF3Anilline - 31P{1H} | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 4 | 08:03:20 | 20260902-0750-B400_B.11-3 | 4060401 | H1_Day16 | w05220ss | + | + | - | + | + | + | + | Ref JA-SiS-IV-06 Group Abbenseth_J JA-SiS-IV-06 P-CF3Anilline - 1H | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 3 | 08:01:19 | 20260902-0750-B400_B.11-3 | 4050532 | P31_NoCPD_Day | w05220ss | - | + | - | - | - | + | + | Ref JA-SiS-IV-05 Group Abbenseth_J JA-SiS-IV-05 P-DBEA - 31P | sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0 |
| 3 | 07:58:53 | 20260902-0750-B400_B.11-3 | 4050531 | P31_Wide_Day | w05220ss | - | + | - | - | - | + | + | Ref JA-SiS-IV-05 Group Abbenseth_J JA-SiS-IV-05 P-DBEA - 31P{1H} | sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0 |
| 3 | 07:52:45 | 20260902-0750-B400_B.11-3 | 4050501 | H1_Day16 | w05220ss | + | + | - | + | + | + | + | Ref JA-SiS-IV-05 Group Abbenseth_J JA-SiS-IV-05 P-DBEA - 1H | |
| 15 | 07:31:58 | 20260902-0726-B400_B.11-15 | 10 | H1_Night | mbdxkrn2 | + | + | - | + | + | + | + | Ref GDB-RN1733 Column Top Band - Basic CDCl3 Group De bo_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 14 | 07:27:13 | 20260902-0725-B400_B.11-14 | 10 | H1_Night | mbdxkrn2 | + | + | - | + | + | + | + | Ref GDB-RN1732 Prep Top Band - Acetone-d6 Group De bo_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 36 | 21:59:10 | 20260901-2153-B400_B.11-36 | 10 | H1_Night128 | m09677nb | + | + | - | + | + | + | + | Ref 2ph no2 Group Greaney_M | |
| 35 | 21:43:15 | 20260901-2123-B400_B.11-35 | 10 | H1_Night128 | f11141tm | + | + | - | + | + | + | + | Ref Cu(Salen)-Mn AOM CH3CN 2mA 1h Group Yang_S | lock: Command 'lock CDCl3' failed. Lock is OFF, sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 34 | 21:40:00 | 20260901-2123-B400_B.11-34 | 10 | H1_Night128 | f11141tm | - | - | - | - | - | - | - | Ref Cu(Salen)-Sm AOM CH3CN 2mA 1h Group Yang_S | |
| 3 | 21:25:08 | 20260901-2027-B400_B.11-3 | 10 | H1_Night128 | m09677nb | + | + | - | + | + | + | + | Ref furyl no2 Group Greaney_M | |
| 60 | 21:19:20 | 20260901-2017-B400_B.11-60 | 10 | H1_Day16 | z83527ql | + | + | - | + | + | + | + | Ref qlt-fuel-br Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 59 | 21:13:39 | 20260901-2016-B400_B.11-59 | 10 | H1_Day16 | z83527ql | + | + | - | + | + | + | + | Ref qlu-poly234-2ndspot Group Leigh_D | |
| 58 | 21:07:00 | 20260901-2016-B400_B.11-58 | 10 | H1_Day16 | z83527ql | + | + | - | + | + | + | + | Ref qlu-poly234-1stspot Group Leigh_D | |
| 57 | 20:10:13 | 20260901-1442-B400_B.11-57 | 11 | C13_CPD_Night1024 | j45159ks | + | + | - | + | + | + | + | Ref nmidep3 Group Keerthi_A | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 37 | 20:05:28 | 20260901-1938-B400_B.11-37 | 10 | H1_Night | a58114lt | + | + | - | + | + | + | + | Ref b2p5-18 Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 36 | 18:36:25 | 20260901-1316-B400_B.11-36 | 10 | H1_Night1024 | mbdxkrn2 | + | + | - | + | + | + | + | Ref GDB-RN-DT003-1 After 5 days sonication, crude material - DMSO-d6 Group De bo_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 5 | 18:31:21 | 20260901-1753-B400_B.11-2 | 40 | H1_Day16 | x06125gb | + | + | - | + | + | + | + | Ref GCGBLyn17-Flush Group Crisenza_G | |
| 4 | 18:26:17 | 20260901-1753-B400_B.11-2 | 30 | H1_Day16 | x06125gb | + | + | - | + | + | + | + | Ref GCGBLynF9-16 Group Crisenza_G | |
| 3 | 18:20:55 | 20260901-1753-B400_B.11-2 | 20 | H1_Day16 | x06125gb | + | + | - | + | + | + | + | Ref GCGB509F2Col3 Group Crisenza_G | |
| 2 | 18:17:44 | 20260901-1753-B400_B.11-2 | 10 | H1_Day16 | x06125gb | - | - | - | - | - | - | - | Ref GCGBPhAcMeOD Group Crisenza_G | |
| 1 | 17:59:30 | 20260901-1216-B400_B.11-1 | 11 | C13_CPD_Night256 | h27839ea | + | + | - | + | + | + | + | Ref donor alixa Olev 2OBz Group Gardiner_J | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 31 | 17:52:45 | 20260901-1306-B400_B.11-31 | 13 | F19_NoCPD_Night | x06125gb | - | + | - | - | - | + | + | Ref GCGBRCS4 Group Crisenza_G | log_err: acqt0 not set in pulse program, result may be incorrect!, log_err: acqt0 not set in pulse program, result may be incorrect!, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0 |
| 31 | 17:37:29 | 20260901-1306-B400_B.11-31 | 12 | C13_CPD_Night256 | x06125gb | - | + | - | - | - | + | + | Ref GCGBRCS4 Group Crisenza_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 31 | 17:22:11 | 20260901-1306-B400_B.11-31 | 11 | H1_Night128 | x06125gb | + | + | - | + | + | + | + | Ref GCGBRCS4 Group Crisenza_G | |
| 24 | 17:19:08 | 20260901-1525-B400_B.11-22 | 30 | H1_Day | w61916tz | + | + | - | + | + | + | + | Ref sy-tz-24-12h-1h Group Yang_S | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 23 | 17:15:58 | 20260901-1525-B400_B.11-22 | 20 | H1_Day | w61916tz | + | + | - | + | + | + | + | Ref sy-tz-23-12h-1h Group Yang_S | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 22 | 17:12:58 | 20260901-1525-B400_B.11-22 | 10 | H1_Day | w61916tz | + | + | - | + | + | + | + | Ref sy-tz-21-12h-1h Group Yang_S | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 13 | 17:09:57 | 20260901-1524-B400_B.11-11 | 30 | H1_Day | w61916tz | + | + | - | + | + | + | + | Ref sy-tz-20-12h-1h Group Yang_S | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 12 | 17:06:40 | 20260901-1524-B400_B.11-11 | 20 | H1_Day | w61916tz | + | + | - | + | + | + | + | Ref sy-tz-19-12h-1h Group Yang_S | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 11 | 17:03:06 | 20260901-1524-B400_B.11-11 | 10 | H1_Day | w61916tz | + | + | - | + | + | + | + | Ref sy-tz-16-12h-1h Group Yang_S | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 8 | 16:57:15 | 20260901-1631-B400_B.11-8 | 11 | H1_COSY_Day | e72206ov | - | + | - | - | - | + | + | Ref ov-021dum2*, 5d Group De bo_G | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 8 | 16:53:27 | 20260901-1631-B400_B.11-8 | 10 | H1_Day | e72206ov | + | + | - | + | + | + | + | Ref ov-021dum2*, 5d Group De bo_G | |
| 7 | 16:50:25 | 20260901-1523-B400_B.11-5 | 30 | H1_Day | w61916tz | + | + | - | + | + | + | + | Ref sy-tz-14-12h-1h Group Yang_S | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 6 | 16:47:17 | 20260901-1523-B400_B.11-5 | 20 | H1_Day | w61916tz | + | + | - | + | + | + | + | Ref sy-tz-13-12h-1h Group Yang_S | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 5 | 16:44:03 | 20260901-1523-B400_B.11-5 | 10 | H1_Day | w61916tz | + | + | - | + | + | + | + | Ref sy-tz-12-12h-1h Group Yang_S | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 4 | 16:40:16 | 20260901-1511-B400_B.11-4 | 10 | H1_Day | c15276ec | + | + | - | + | + | + | + | Ref exc252-kcl-bulky-cepump Group Leigh_D exc252-kcl-bulky-cepump | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 3 | 16:35:58 | 20260901-1511-B400_B.11-3 | 10 | H1_Day | c15276ec | + | + | - | + | + | + | + | Ref exc252-nacl-bulky-cepump Group Leigh_D exc252-nacl-bulky-cepump | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 2 | 16:31:16 | 20260901-1511-B400_B.11-2 | 10 | H1_Day | c15276ec | + | + | - | + | + | + | + | Ref exc252-nosalt-bulky-cepump Group Leigh_D exc252-nosalt-bulky-cepump | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 1 | 16:26:06 | 20260901-1216-B400_B.11-1 | 10 | H1_Day | h27839ea | + | + | - | + | + | + | + | Ref donor alixa Olev 2OBz Group Gardiner_J | |
| 60 | 16:20:47 | 20260901-1614-B400_B.11-60 | 10 | H1_Day | j82494jb | + | + | - | + | + | + | + | Ref QBB-G154-1hr Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 59 | 16:17:30 | 20260901-1453-B400_B.11-59 | 10 | H1_Day | m52750pm | + | + | - | + | + | + | + | Ref GCPM395B-cr Group Crisenza_G | |
| 58 | 16:14:14 | 20260901-1453-B400_B.11-58 | 10 | H1_Day | m52750pm | + | + | - | + | + | + | + | Ref GCPM395A-cr Group Crisenza_G | |
| 57 | 16:08:44 | 20260901-1442-B400_B.11-57 | 10 | H1_Day16 | j45159ks | + | + | - | + | + | + | + | Ref nmidep3 Group Keerthi_A | |
| 56 | 15:54:57 | 20260901-1409-B400_B.11-56 | 10 | H1_Day16 | mbdxkrn2 | + | + | - | + | + | + | + | Ref GDB-RN1730-1 Crude polymer after 2nd reaction - Basic CDCl3 Group De bo_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 55 | 15:48:40 | 20260901-1421-B400_B.11-55 | 10 | H1_Day | z83527ql | + | + | - | + | + | + | + | Ref qlc-p1-sm-check Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 53 | 15:46:09 | 20260827-1437-B400_B.11-53 | 12 | H1_Day16 | d08103sl | - | + | - | - | - | + | + | Ref sl-se-14 Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 53 | 15:39:03 | 20260827-1437-B400_B.11-53 | 11 | H1_Day16 | d93111sd | + | + | - | + | + | + | + | Ref IL-SD-528 Group Larrosa_I | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 52 | 15:25:22 | 20260901-1408-B400_B.11-52 | 10 | H1_Day16 | mbdxkrn2 | + | + | - | + | + | + | + | Ref GDB-RN1624-2 Crude polymer after 2nd reaction - Basic CDCl3 Group De bo_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 51 | 15:24:54 | 20260901-1408-B400_B.11-51 | 10 | H1_Day | j82494jb | - | - | - | - | - | - | - | Ref QBB Group Leigh_D | |
| 50 | 15:19:06 | 20260901-1403-B400_B.11-50 | 10 | H1_Day16 | h32367lm | + | + | - | + | + | + | + | Ref LM_FCat_LAH_1wk Group Leigh_D | |
| 49 | 15:12:51 | 20260901-1403-B400_B.11-49 | 10 | H1_Day16 | h32367lm | + | + | - | + | + | + | + | Ref LM_FCat_LAH_Clean_Wknd Group Leigh_D | |
| 48 | 15:06:11 | 20260901-1401-B400_B.11-48 | 10 | H1_Day | y01348dm | + | + | - | + | + | + | + | Ref vsb-14 Group Keerthi_A | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 47 | 15:00:47 | 20260901-1358-B400_B.11-47 | 10 | H1_Day16 | n29715ss | + | + | - | + | + | + | + | Ref DJP-SS-Bcatstyreneandacrylate Group Procter_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 46 | 14:56:38 | 20260901-1358-B400_B.11-46 | 10 | H1_Day | j82494jb | + | + | - | + | + | + | + | Ref QBB-G153-2hrs Group Leigh_D | |
| 45 | 14:54:00 | 20260901-1354-B400_B.11-45 | 11 | B11_CPD_Day | n29715ss | - | + | - | - | - | + | + | Ref CPS-101 cr IS 3h Group Procter_D | sref: NUCLEUS '11B' not defined for SOLVENT 'CDCl3' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Procter_D/data/n29715ss/nmr/20260901-1354-B400_B.11-45/11/pdata/1/peaks!, sref: NUCLEUS '11B' not defined for SOLVENT 'CDCl3' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Procter_D/data/n29715ss/nmr/20260901-1354-B400_B.11-45/11/pdata/1/peaks! |
| 45 | 14:50:37 | 20260901-1354-B400_B.11-45 | 10 | H1_Day | n29715ss | + | + | - | + | + | + | + | Ref CPS-101 cr IS 3h Group Procter_D | |
| 44 | 14:44:47 | 20260901-1352-B400_B.11-44 | 10 | H1_Day | p07890rp | + | + | - | + | + | + | + | Ref GDB-RP-108-FC-B Group De bo_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 43 | 14:39:08 | 20260901-1352-B400_B.11-43 | 10 | H1_Day | p07890rp | + | + | - | + | + | + | + | Ref GDB-RP-108-FC-A Group De bo_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 42 | 14:34:21 | 20260901-1350-B400_B.11-42 | 10 | H1_Day | a44936mc | + | + | - | + | + | + | + | Ref mc-macro-no-cl-check Group Leigh_D | |
| 41 | 14:29:26 | 20260901-1347-B400_B.11-41 | 10 | H1_Day16 | m46745sw | + | + | - | + | + | + | + | Ref 111-p Group Natrajan_L | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 40 | 14:24:34 | 20260901-1344-B400_B.11-40 | 10 | F19_NoCPD_Day | z86427mk | + | + | - | + | + | + | + | Ref sa-47 fluorine fRn1 Group Procter_D | log_err: acqt0 not set in pulse program, result may be incorrect!, log_err: acqt0 not set in pulse program, result may be incorrect!, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0 |
| 39 | 14:20:31 | 20260901-1329-B400_B.11-39 | 10 | H1_Day | u67812sg | + | + | - | + | + | + | + | Ref sq-2-76-5-0901 Group Procter_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 38 | 14:16:10 | 20260901-1329-B400_B.11-38 | 10 | H1_Day | u67812sg | + | + | - | + | + | + | + | Ref sq-2-76-4-0901 Group Procter_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 37 | 14:11:52 | 20260901-1328-B400_B.11-37 | 10 | H1_Day | u67812sg | + | + | - | + | + | + | + | Ref sq-2-76-3-0901 Group Procter_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 35 | 13:57:51 | 20260901-1315-B400_B.11-35 | 10 | H1_Day16 | mbdxkrn2 | + | + | - | + | + | + | + | Ref GDB-RN1712-3 MeCN-washed polymer - Basic CDCl3 Group De bo_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 34 | 13:54:27 | 20260901-1309-B400_B.11-34 | 10 | H1_Day | j45795fh | + | + | - | + | + | + | + | Ref fhc-295 Group Leigh_D fhc-295 | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 33 | 13:51:14 | 20260827-1216-B400_B.11-32 | 21 | H1_Day | z86427mk | + | + | - | + | + | + | + | Ref MK-384 F16 Group Procter_D | |
| 32 | 13:46:12 | 20260827-1216-B400_B.11-32 | 11 | H1_Day16 | x06125gb | + | + | - | + | + | + | + | Ref GCGBPhAcCyApp Group Crisenza_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 31 | 13:40:58 | 20260901-1306-B400_B.11-31 | 10 | H1_Day16 | x06125gb | + | + | - | + | + | + | + | Ref GCGBRCS4 Group Crisenza_G | |
| 30 | 13:36:19 | 20260901-1245-B400_B.11-30 | 10 | H1_Day16 | p13528bg | + | + | - | + | + | + | + | Ref BG-060 post column beaker Group De bo_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 29 | 13:33:47 | 20260901-1241-B400_B.11-29 | 11 | C13_CPD_Day | a60960ax | - | + | - | - | - | + | + | Ref ar-ax69-productf2 Group Keerthi_A | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 29 | 13:29:23 | 20260901-1241-B400_B.11-29 | 10 | H1_Day | a60960ax | + | + | - | + | + | + | + | Ref ar-ax69-productf2 Group Keerthi_A | |
| 26 | 13:24:54 | 20260901-1232-B400_B.11-26 | 10 | H1_Day | z86427mk | + | + | - | + | + | + | + | Ref sa-47-f2 Group Procter_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 25 | 13:20:41 | 20260901-1231-B400_B.11-25 | 10 | H1_Day | z86427mk | + | + | - | + | + | + | + | Ref sa-47 f1 Group Procter_D | |
| 24 | 13:16:20 | 20260901-1229-B400_B.11-24 | 10 | H1_Day | e72206ov | + | + | - | + | + | + | + | Ref ov-021dum3, 5d check Group De bo_G | |
| 23 | 13:10:53 | 20260901-1210-B400_B.11-22 | 20 | H1_Day16 | v73981ac | + | + | - | + | + | + | + | Ref IL-AC-ANG-15-F5 Group Larrosa_I | |
| 22 | 13:05:46 | 20260901-1210-B400_B.11-22 | 10 | H1_Day16 | v73981ac | + | + | - | + | + | + | + | Ref IL-AC-ANG-15-F4 Group Larrosa_I | |
| 20 | 12:59:55 | 20260901-1214-B400_B.11-20 | 10 | H1_Day16 | h32367lm | + | + | - | + | + | + | + | Ref LM_FMac_LAH_wknd Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 16 | 12:55:27 | 20260901-1215-B400_B.11-16 | 10 | H1_Day | j82494jb | + | + | - | + | + | + | + | Ref QBB-G153-MeOH-quench Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 15 | 12:48:54 | 20260901-1213-B400_B.11-15 | 10 | H1_Day16 | d93111sd | + | + | - | + | + | + | + | Ref IL-SD2-32-final Group Larrosa_I | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 14 | 12:43:03 | 20260901-1211-B400_B.11-14 | 11 | H1_COSY_Day | f09303eg | - | + | - | - | - | + | + | Ref EG99 Group Webb_S | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 14 | 12:38:21 | 20260901-1211-B400_B.11-14 | 10 | H1_Day | f09303eg | + | + | - | + | + | + | + | Ref EG99 Group Webb_S | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 13 | 12:32:58 | 20260901-1209-B400_B.11-11 | 30 | H1_Day16 | v73981ac | + | + | - | + | + | + | + | Ref IL-AC-ANG-15-F3 Group Larrosa_I | |
| 12 | 12:27:52 | 20260901-1209-B400_B.11-11 | 20 | H1_Day16 | v73981ac | + | + | - | + | + | + | + | Ref IL-AC-ANG-15-F2 Group Larrosa_I | |
| 11 | 12:21:53 | 20260901-1209-B400_B.11-11 | 10 | H1_Day16 | v73981ac | + | + | - | + | + | + | + | Ref IL-AC-ANG-15-F1 Group Larrosa_I | |
| 10 | 12:16:00 | 20260901-1043-B400_B.11-10 | 11 | H1_COSY_Day | w83786og | - | + | - | - | - | + | + | Ref MIG-OWG003.5.1 Group Gibson_M | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 10 | 12:11:30 | 20260901-1043-B400_B.11-10 | 10 | H1_Day | w83786og | + | + | - | + | + | + | + | Ref MIG-OWG003.5.1 Group Gibson_M | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 9 | 10:35:34 | 20260901-0941-B400_B.11-9 | 10 | H1_Night128 | f11141tm | + | + | - | + | + | + | + | Ref Cu(Salen)-La Acetone reduction 2mA 1h Group Yang_S | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 8 | 10:21:53 | 20260901-0940-B400_B.11-8 | 10 | H1_Night128 | f11141tm | + | + | - | + | + | + | + | Ref Cu(Salen)-Mn Acetone reduction 5mA 1h Group Yang_S | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 7 | 10:06:58 | 20260901-0940-B400_B.11-7 | 10 | H1_Night128 | f11141tm | + | + | - | + | + | + | + | Ref Cu(Salen)-Mn Acetone reduction 2mA 1h Group Yang_S | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 4 | 10:04:58 | 20260901-0935-B400_B.11-2 | 3080232 | P31_NoCPD_Day | w05220ss | - | + | - | - | - | + | + | Ref JA-SiS-IV-08 Group Abbenseth_J JA-SiS-IV-08 P MesNH2 - 31P | sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0 |
| 4 | 10:03:09 | 20260901-0935-B400_B.11-2 | 3080231 | P31_Wide_Day | w05220ss | - | + | - | - | - | + | + | Ref JA-SiS-IV-08 Group Abbenseth_J JA-SiS-IV-08 P MesNH2 - 31P{1H} | sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0 |
| 4 | 09:56:39 | 20260901-0935-B400_B.11-2 | 3080201 | H1_Day16 | w05220ss | + | + | - | + | + | + | + | Ref JA-SiS-IV-08 Group Abbenseth_J JA-SiS-IV-08 P MesNH2 - 1H | |
| 3 | 09:54:30 | 20260901-0935-B400_B.11-2 | 3060319 | F19_NoCPD_Day | w05220ss | - | + | - | - | - | + | + | Ref JA-SiS-IV-06 Group Abbenseth_J JA-SiS-IV-06 P CF3 Aniline - 319F | log_err: acqt0 not set in pulse program, result may be incorrect!, log_err: acqt0 not set in pulse program, result may be incorrect!, sref: NUCLEUS '19F' not defined for SOLVENT 'C6D6' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'C6D6' SR is set to 0.0 |
| 3 | 09:52:30 | 20260901-0935-B400_B.11-2 | 3060332 | P31_NoCPD_Day | w05220ss | - | + | - | - | - | + | + | Ref JA-SiS-IV-06 Group Abbenseth_J JA-SiS-IV-06 P CF3 Aniline - 31P | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 3 | 09:50:47 | 20260901-0935-B400_B.11-2 | 3060331 | P31_Wide_Day | w05220ss | - | + | - | - | - | + | + | Ref JA-SiS-IV-06 Group Abbenseth_J JA-SiS-IV-06 P CF3 Aniline - 31P{1H} | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 3 | 09:46:45 | 20260901-0935-B400_B.11-2 | 3060301 | H1_Day16 | w05220ss | + | + | - | + | + | + | + | Ref JA-SiS-IV-06 Group Abbenseth_J JA-SiS-IV-06 P CF3 Aniline - 1H | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 2 | 09:44:45 | 20260901-0935-B400_B.11-2 | 3050432 | P31_NoCPD_Day | w05220ss | - | + | - | - | - | + | + | Ref JA-SiS-IV-05 Group Abbenseth_J JA-SiS-IV-05 P DEA - 31P | sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0 |
| 2 | 09:42:20 | 20260901-0935-B400_B.11-2 | 3050431 | P31_Wide_Day | w05220ss | - | + | - | - | - | + | + | Ref JA-SiS-IV-05 Group Abbenseth_J JA-SiS-IV-05 P DEA - 31P{1H} | sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0 |
| 2 | 09:36:36 | 20260901-0935-B400_B.11-2 | 3050401 | H1_Day16 | w05220ss | + | + | - | + | + | + | + | Ref JA-SiS-IV-05 Group Abbenseth_J JA-SiS-IV-05 P DEA - 1H | |
| 48 | 01:36:04 | 20260831-1834-B400_B.11-48 | 11 | C13_DEPT135_Night | m52750pm | - | + | - | - | - | + | + | Ref GCPM394F2-D Group Crisenza_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 48 | 01:17:10 | 20260831-1834-B400_B.11-48 | 10 | C13_CPD_Night256 | m52750pm | + | + | - | + | x | + | + | Ref GCPM394F2-C Group Crisenza_G | topshim: TopshimPerformShimming - too many points lost during fit, Shim failed, sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 60 | 01:11:34 | 20260831-1828-B400_B.11-60 | 12 | Si29_DEPT90_Day | b19299kh | - | + | - | - | - | + | + | Ref STL-XLD-Rb2C4TMS-2 drops of dthf-C6D6 Group Liddle_S | sref: NUCLEUS '29Si' not defined for SOLVENT 'C6D6' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Liddle_S/data/b19299kh/nmr/20260831-1828-B400_B.11-60/12/pdata/1/peaks!, sref: NUCLEUS '29Si' not defined for SOLVENT 'C6D6' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Liddle_S/data/b19299kh/nmr/20260831-1828-B400_B.11-60/12/pdata/1/peaks! |
| 60 | 23:45:03 | 20260831-1828-B400_B.11-60 | 11 | H1_Night1024 | b19299kh | - | + | - | - | - | + | + | Ref STL-XLD-Rb2C4TMS-2 drops of dthf-C6D6 Group Liddle_S | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 60 | 23:30:44 | 20260831-1828-B400_B.11-60 | 10 | H1_Night128 | b19299kh | + | + | - | + | + | + | + | Ref STL-XLD-Rb2C4TMS-2 drops of dthf-C6D6 Group Liddle_S | |
| 54 | 23:30:10 | 20260831-1704-B400_B.11-54 | 10 | C13_CPD_Night1024 | m09677nb | x | - | - | - | - | - | - | Ref 2ph no2 Group Greaney_M | WebService Error: 103.310.145:Sample Missing Error:No sample found with Position or Tube ID '1.54'. |
| 43 | 22:55:01 | 20260831-1614-B400_B.11-43 | 14 | H1_C13_HMBC_Night | u67812sg | - | + | - | - | - | + | + | Ref sq-2-77-2-0831 Group Procter_D | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 43 | 22:39:39 | 20260831-1614-B400_B.11-43 | 13 | H1_C13_HSQC_Night | u67812sg | - | + | - | - | - | + | + | Ref sq-2-77-2-0831 Group Procter_D | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 43 | 22:26:11 | 20260831-1614-B400_B.11-43 | 12 | H1_COSY_HiRes_Night | u67812sg | - | + | - | - | - | + | + | Ref sq-2-77-2-0831 Group Procter_D | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 43 | 22:11:55 | 20260831-1614-B400_B.11-43 | 11 | C13_CPD_Night256 | u67812sg | - | + | - | - | - | + | + | Ref sq-2-77-2-0831 Group Procter_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 43 | 22:06:27 | 20260831-1614-B400_B.11-43 | 10 | H1_Night | u67812sg | + | + | - | + | + | + | + | Ref sq-2-77-2-0831 Group Procter_D | |
| 42 | 21:31:19 | 20260831-1613-B400_B.11-42 | 14 | H1_C13_HMBC_Night | u67812sg | - | + | - | - | - | + | + | Ref sq-2-77-1-0831 Group Procter_D | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 42 | 21:12:36 | 20260831-1613-B400_B.11-42 | 13 | H1_C13_HSQC_Night | u67812sg | + | + | - | + | + | + | + | Ref sq-2-77-1-0831 Group Procter_D | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 4 | 20:59:49 | 20260831-1258-B400_B.11-4 | 15 | H1_NOESY_Night | mbdxkrn2 | - | + | - | - | - | + | + | Ref GDB-RN1731 Full Char - Basic CDCl3 Group De bo_G | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 4 | 20:46:20 | 20260831-1258-B400_B.11-4 | 14 | H1_COSY_HiRes_Night | mbdxkrn2 | - | + | - | - | - | + | + | Ref GDB-RN1731 Full Char - Basic CDCl3 Group De bo_G | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 4 | 20:31:00 | 20260831-1258-B400_B.11-4 | 13 | H1_C13_HSQC_Night | mbdxkrn2 | - | + | - | - | - | + | + | Ref GDB-RN1731 Full Char - Basic CDCl3 Group De bo_G | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 4 | 19:55:50 | 20260831-1258-B400_B.11-4 | 12 | H1_C13_HMBC_Night | mbdxkrn2 | - | + | - | - | - | + | + | Ref GDB-RN1731 Full Char - Basic CDCl3 Group De bo_G | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 4 | 19:50:48 | 20260831-1258-B400_B.11-4 | 11 | H1_Night | mbdxkrn2 | + | + | - | + | + | + | + | Ref GDB-RN1731 Full Char - Basic CDCl3 Group De bo_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 5 | 19:44:47 | 20260831-1918-B400_B.11-5 | 10 | H1_Night | n29715ss | + | + | - | + | + | + | + | Ref DJP-SS-BcatDCMrt2hrs Group Procter_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 4 | 18:48:11 | 20260831-1258-B400_B.11-4 | 10 | C13_CPD_Night1024 | mbdxkrn2 | + | + | - | + | + | + | + | Ref GDB-RN1731 Full Char - Basic CDCl3 Group De bo_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 5 | 18:20:53 | 20260831-0732-B400_B.11-5 | 15 | C13_DEPTQ_Night | x06125gb | - | + | - | - | - | + | + | Ref GCGB514F9-15 Group Crisenza_G | |
| 5 | 17:42:21 | 20260831-0732-B400_B.11-5 | 14 | H1_C13_HMBC_Night | x06125gb | + | + | - | + | + | + | + | Ref GCGB514F9-15 Group Crisenza_G | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 42 | 17:24:51 | 20260831-1613-B400_B.11-42 | 12 | H1_COSY_HiRes_Night | u67812sg | + | + | - | + | + | + | + | Ref sq-2-77-1-0831 Group Procter_D | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 52 | 17:20:56 | 20260831-1702-B400_B.11-51 | 20 | H1_Day16 | x06125gb | + | + | - | + | + | + | + | Ref GCGBAubagioAq Group Crisenza_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 51 | 17:16:25 | 20260831-1702-B400_B.11-51 | 10 | H1_Day16 | x06125gb | + | + | - | + | + | + | + | Ref GCGBAubagioAcetone Group Crisenza_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 50 | 17:11:57 | 20260831-1655-B400_B.11-50 | 10 | H1_Day | m52750pm | + | + | - | + | + | + | + | Ref GCPM394F4 Group Crisenza_G | |
| 49 | 17:07:36 | 20260831-1655-B400_B.11-49 | 10 | H1_Day | m52750pm | + | + | - | + | + | + | + | Ref GCPM394F3 Group Crisenza_G | |
| 48 | 17:02:54 | 20260831-1655-B400_B.11-48 | 10 | H1_Day | m52750pm | + | + | - | + | + | + | + | Ref GCPM394F2 Group Crisenza_G | |
| 47 | 16:58:09 | 20260831-1655-B400_B.11-47 | 10 | H1_Day | m52750pm | + | + | - | + | + | + | + | Ref GCPM394F1 Group Crisenza_G | |
| 46 | 16:43:54 | 20260831-1637-B400_B.11-46 | 11 | C13_CPD_Night256 | z16689fe | - | + | - | - | - | + | + | Ref DJP TLmethylsub re Group Procter_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 46 | 16:40:38 | 20260831-1637-B400_B.11-46 | 10 | H1_Day | z16689fe | + | + | - | + | + | + | + | Ref DJP TLmethylsub re Group Procter_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 44 | 16:33:29 | 20260831-1630-B400_B.11-44 | 10 | H1_Day16 | d93111sd | + | + | - | + | + | + | + | Ref IL-SD2-31-x Group Larrosa_I | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 42 | 16:19:08 | 20260831-1613-B400_B.11-42 | 11 | C13_CPD_Night256 | u67812sg | - | + | - | - | - | + | + | Ref sq-2-77-1-0831 Group Procter_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 42 | 16:14:23 | 20260831-1613-B400_B.11-42 | 10 | H1_Night | u67812sg | + | + | - | + | + | + | + | Ref sq-2-77-1-0831 Group Procter_D | |
| 41 | 15:13:59 | 20260831-1513-B400_B.11-41 | 10 | H1_Night128 | mbdxkrn2 | + | + | - | + | + | + | + | Ref GDB-RN1407-21 Crude polymer - Basic CDCl3 Group De bo_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 14 | 14:38:35 | 20260831-1437-B400_B.11-14 | 10 | H1_Day16 | n29715ss | + | + | - | + | + | + | + | Ref DJP-SS-Bcatacetoneroomtemp1hr Group Procter_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 13 | 14:12:00 | 20260831-1411-B400_B.11-13 | 10 | H1_Night128 | mbdxkrn2 | + | + | - | + | + | + | + | Ref GDB-RN 20kDa PEG-NH2 - Basic CDCl3 Group De bo_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 6 | 13:40:17 | 20260831-1339-B400_B.11-6 | 10 | H1_Day16 | x06125gb | + | + | - | + | + | + | + | Ref GCGB514Wash2 Group Crisenza_G | |
| 8 | 13:15:20 | 20260831-1256-B400_B.11-8 | 10 | H1_Day16 | mbdxkrn2 | + | + | - | + | + | + | + | Ref GDB-RN1730-1 Crude polymer - Basic CDCl3 Group De bo_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 7 | 13:01:09 | 20260831-1256-B400_B.11-7 | 10 | H1_Day16 | mbdxkrn2 | + | + | - | + | + | + | + | Ref GDB-RN1624-2 Crude polymer - Basic CDCl3 Group De bo_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 6 | 12:59:07 | 20260831-1250-B400_B.11-6 | 12 | F19_NoCPD_Day | x06125gb | - | + | - | - | - | + | + | Ref GCGBAubagioAttempt1 Group Crisenza_G | log_err: acqt0 not set in pulse program, result may be incorrect!, log_err: acqt0 not set in pulse program, result may be incorrect!, sref: NUCLEUS '19F' not defined for SOLVENT 'DMSO' SR is set to 0.0; pp: Cannot find any peak for scaling in /mnt/nmrdata/Crisenza_G/data/x06125gb/nmr/20260831-1250-B400_B.11-6/12/pdata/1/peaks!, sref: NUCLEUS '19F' not defined for SOLVENT 'DMSO' SR is set to 0.0; pp: Cannot find any peak for scaling in /mnt/nmrdata/Crisenza_G/data/x06125gb/nmr/20260831-1250-B400_B.11-6/12/pdata/1/peaks! |
| 6 | 12:56:23 | 20260831-1250-B400_B.11-6 | 11 | C13_CPD_Day | x06125gb | - | + | - | - | - | + | + | Ref GCGBAubagioAttempt1 Group Crisenza_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 6 | 12:51:57 | 20260831-1250-B400_B.11-6 | 10 | H1_Day16 | x06125gb | + | + | - | + | + | + | + | Ref GCGBAubagioAttempt1 Group Crisenza_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 4 | 12:44:01 | 20260831-1240-B400_B.11-4 | 10 | H1_Day16 | mbdxkrn2 | + | + | - | + | + | + | + | Ref GDB-RN1731 Column Fractions 83-95 - Basic CDCl3 Group De bo_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 3 | 12:39:07 | 20260831-1237-B400_B.11-3 | 10 | H1_Day16 | d08103sl | + | + | - | + | + | + | + | Ref sl-se-14-18 cd3cn Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 2 | 12:14:18 | 20260831-1207-B400_B.11-1 | 20 | H1_Day16 | d08103sl | + | + | - | + | + | + | + | Ref sl-se-14-12 Group Leigh_D | |
| 1 | 12:08:15 | 20260831-1207-B400_B.11-1 | 10 | H1_Day16 | d08103sl | + | + | - | + | + | + | + | Ref sl-se-14-18 Group Leigh_D | |
| 7 | 11:45:00 | 20260831-1138-B400_B.11-7 | 11 | B11_CPD_Day | n29715ss | - | + | - | - | - | + | + | Ref DJP-SS-Bcatonlyacetone Group Procter_D | sref: NUCLEUS '11B' not defined for SOLVENT 'CDCl3' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Procter_D/data/n29715ss/nmr/20260831-1138-B400_B.11-7/11/pdata/1/peaks!, sref: NUCLEUS '11B' not defined for SOLVENT 'CDCl3' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Procter_D/data/n29715ss/nmr/20260831-1138-B400_B.11-7/11/pdata/1/peaks! |
| 7 | 11:40:01 | 20260831-1138-B400_B.11-7 | 10 | H1_Day16 | n29715ss | + | + | - | + | + | + | + | Ref DJP-SS-Bcatonlyacetone Group Procter_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 7 | 11:28:58 | 20260831-0801-B400_B.11-6 | 29 | F19_NoCPD_Night | d93111sd | + | + | - | + | + | + | + | Ref IL-SD-465-r-C Group Larrosa_I | log_err: acqt0 not set in pulse program, result may be incorrect!, log_err: acqt0 not set in pulse program, result may be incorrect!, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0 |
| 9 | 11:15:25 | 20260831-1051-B400_B.11-9 | 10 | H1_Day16 | mbdxkrn2 | + | + | - | + | + | + | + | Ref GDB-RN1712-3 MeCN-washed polymer - Basic CDCl3 Group De bo_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 8 | 11:10:04 | 20260831-1051-B400_B.11-8 | 10 | H1_Day16 | mbdxkrn2 | + | + | - | + | + | + | + | Ref GDB-RN1731 Column Fractions 66-82 - Basic CDCl3 Group De bo_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 6 | 11:04:26 | 20260831-1050-B400_B.11-6 | 10 | H1_Day16 | mbdxkrn2 | + | + | - | + | + | + | + | Ref GDB-RN1731 Column Fractions 48-65 - Basic CDCl3 Group De bo_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 5 | 10:48:13 | 20260831-0732-B400_B.11-5 | 13 | H1_C13_HSQC_Night | x06125gb | - | + | - | - | - | + | + | Ref GCGB514F9-15 Group Crisenza_G | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 5 | 10:31:08 | 20260831-0732-B400_B.11-5 | 12 | H1_COSY_HiRes_Night | x06125gb | + | + | - | + | + | + | + | Ref GCGB514F9-15 Group Crisenza_G | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 22 | 10:29:08 | 20260831-1007-B400_B.11-22 | 4080132 | P31_NoCPD_Day | w05220ss | - | + | - | - | - | + | + | Ref JA-SiS-IV-08 Group Abbenseth_J JA-SiS-IV-08 P-NMes - 31P | sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0 |
| 22 | 10:23:54 | 20260831-1007-B400_B.11-22 | 4080131 | P31_Wide_Day | w05220ss | + | + | - | + | + | + | + | Ref JA-SiS-IV-08 Group Abbenseth_J JA-SiS-IV-08 P-NMes - 31P{1H} | sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0 |
| 23 | 10:18:27 | 20260831-1015-B400_B.11-23 | 10 | H1_Day16 | n29715ss | + | + | - | + | + | + | + | Ref DJP-SS_Bcatafter12hrsnmr Group Procter_D | |
| 22 | 10:13:01 | 20260831-1007-B400_B.11-22 | 4080101 | H1_Day16 | w05220ss | + | + | - | + | + | + | + | Ref JA-SiS-IV-08 Group Abbenseth_J JA-SiS-IV-08 P-NMes - 1H | |
| 15 | 10:02:35 | 20260831-0813-B400_B.11-13 | 30 | H1_Quant_Night | d93111sd | + | + | - | + | + | + | + | Ref IL-SD-527 Group Larrosa_I | |
| 4 | 10:00:44 | 20260831-0730-B400_B.11-3 | 4060219 | F19_NoCPD_Day | w05220ss | - | + | - | - | - | + | + | Ref JA-SiS-IV-06 Group Abbenseth_J JA-SiS-IV-06 P CF3 Aniline - 19F | log_err: acqt0 not set in pulse program, result may be incorrect!, log_err: acqt0 not set in pulse program, result may be incorrect!, sref: NUCLEUS '19F' not defined for SOLVENT 'C6D6' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'C6D6' SR is set to 0.0 |
| 4 | 09:58:44 | 20260831-0730-B400_B.11-3 | 4060232 | P31_NoCPD_Day | w05220ss | - | + | - | - | - | + | + | Ref JA-SiS-IV-06 Group Abbenseth_J JA-SiS-IV-06 P CF3 Aniline - 31P | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 4 | 09:56:20 | 20260831-0730-B400_B.11-3 | 4060231 | P31_Wide_Day | w05220ss | - | + | - | - | - | + | + | Ref JA-SiS-IV-06 Group Abbenseth_J JA-SiS-IV-06 P CF3 Aniline - 31P{1H} | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 4 | 09:52:08 | 20260831-0730-B400_B.11-3 | 4060201 | H1_Day16 | w05220ss | + | + | - | + | + | + | + | Ref JA-SiS-IV-06 Group Abbenseth_J JA-SiS-IV-06 P CF3 Aniline - 1H | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 15 | 09:48:34 | 20260831-0813-B400_B.11-13 | 31 | F19_NoCPD_Day | d93111sd | + | + | - | + | + | + | + | Ref IL-SD-527 Group Larrosa_I | log_err: acqt0 not set in pulse program, result may be incorrect!, log_err: acqt0 not set in pulse program, result may be incorrect!, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0 |
| 14 | 09:46:31 | 20260831-0813-B400_B.11-13 | 21 | F19_NoCPD_Day | d93111sd | - | + | - | - | - | + | + | Ref IL-SD-526 Group Larrosa_I | log_err: acqt0 not set in pulse program, result may be incorrect!, log_err: acqt0 not set in pulse program, result may be incorrect!, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0 |
| 14 | 09:34:19 | 20260831-0813-B400_B.11-13 | 20 | H1_Quant_D1_25s_Day | d93111sd | + | + | - | + | + | + | + | Ref IL-SD-526 Group Larrosa_I | |
| 13 | 09:32:15 | 20260831-0813-B400_B.11-13 | 11 | F19_NoCPD_Day | d93111sd | - | + | - | - | - | + | + | Ref IL-SD-524 Group Larrosa_I | log_err: acqt0 not set in pulse program, result may be incorrect!, log_err: acqt0 not set in pulse program, result may be incorrect!, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0 |
| 13 | 09:16:30 | 20260831-0813-B400_B.11-13 | 10 | H1_Quant_D1_25s_Day | d93111sd | + | + | - | + | + | + | + | Ref IL-SD-524 Group Larrosa_I | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 9 | 09:14:26 | 20260831-0801-B400_B.11-6 | 59 | F19_NoCPD_Day | d93111sd | - | + | - | - | - | + | + | Ref IL-SD-465-r-E Group Larrosa_I | log_err: acqt0 not set in pulse program, result may be incorrect!, log_err: acqt0 not set in pulse program, result may be incorrect!, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0 |
| 9 | 09:01:44 | 20260831-0801-B400_B.11-6 | 58 | H1_Quant_D1_25s_Day | d93111sd | + | + | - | + | + | + | + | Ref IL-SD-465-r-E Group Larrosa_I | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 8 | 08:51:05 | 20260831-0801-B400_B.11-6 | 43 | H1_Quant_D1_25s_Day | d93111sd | - | + | - | - | - | + | + | Ref IL-SD-465-r-D Group Larrosa_I | |
| 8 | 08:47:14 | 20260831-0801-B400_B.11-6 | 40 | F19_NoCPD_Day | d93111sd | + | + | - | + | + | + | + | Ref IL-SD-465-r-D Group Larrosa_I | log_err: acqt0 not set in pulse program, result may be incorrect!, log_err: acqt0 not set in pulse program, result may be incorrect!, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0 |
| 7 | 08:37:12 | 20260831-0801-B400_B.11-6 | 28 | H1_Quant_Night | d93111sd | + | + | - | + | + | + | + | Ref IL-SD-465-r-C Group Larrosa_I | |
| 6 | 08:30:26 | 20260831-0801-B400_B.11-6 | 19 | F19_NoCPD_Night | d93111sd | - | + | - | - | - | + | + | Ref IL-SD-465-r-B Group Larrosa_I | log_err: acqt0 not set in pulse program, result may be incorrect!, log_err: acqt0 not set in pulse program, result may be incorrect!, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0 |
| 6 | 08:21:31 | 20260831-0801-B400_B.11-6 | 18 | H1_Quant_Night | d93111sd | + | + | - | + | + | + | + | Ref IL-SD-465-r-B Group Larrosa_I | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 10 | 08:14:47 | 20260831-0801-B400_B.11-6 | 51 | F19_NoCPD_Night | d93111sd | - | + | - | - | - | + | + | Ref IL-SD-465-r-F Group Larrosa_I | log_err: acqt0 not set in pulse program, result may be incorrect!, log_err: acqt0 not set in pulse program, result may be incorrect!, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0 |
| 10 | 08:05:56 | 20260831-0801-B400_B.11-6 | 50 | H1_Quant_Night | d93111sd | + | + | - | + | + | + | + | Ref IL-SD-465-r-F Group Larrosa_I | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 5 | 07:50:19 | 20260831-0732-B400_B.11-5 | 11 | C13_CPD_Night256 | x06125gb | - | + | - | - | - | + | + | Ref GCGB514F9-15 Group Crisenza_G | |
| 5 | 07:42:34 | 20260831-0732-B400_B.11-5 | 10 | H1_Night | x06125gb | + | + | - | + | + | + | + | Ref GCGB514F9-15 Group Crisenza_G | |
| 3 | 07:40:34 | 20260831-0730-B400_B.11-3 | 4050332 | P31_NoCPD_Day | w05220ss | - | + | - | - | - | + | + | Ref JA-SiS-IV-05 Group Abbenseth_J JA-SiS-IV-05 P-DEA - 31P | sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0 |
| 3 | 07:37:39 | 20260831-0730-B400_B.11-3 | 4050331 | P31_Wide_Day | w05220ss | - | + | - | - | - | + | + | Ref JA-SiS-IV-05 Group Abbenseth_J JA-SiS-IV-05 P-DEA - 31P{1H} | sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0 |
| 3 | 07:31:34 | 20260831-0730-B400_B.11-3 | 4050301 | H1_Day16 | w05220ss | + | + | - | + | + | + | + | Ref JA-SiS-IV-05 Group Abbenseth_J JA-SiS-IV-05 P-DEA - 1H | |
| 2 | 07:27:43 | 20260831-0658-B400_B.11-1 | 21 | F19_NoCPD_Day | d93111sd | - | + | - | - | - | + | + | Ref IL-SD-465-r-A Group Larrosa_I | log_err: acqt0 not set in pulse program, result may be incorrect!, log_err: acqt0 not set in pulse program, result may be incorrect!, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0 |
| 2 | 07:15:08 | 20260831-0658-B400_B.11-1 | 20 | H1_Quant_D1_25s_Day | d93111sd | + | + | - | + | + | + | + | Ref IL-SD-465-r-A Group Larrosa_I | |
| 1 | 07:12:59 | 20260831-0658-B400_B.11-1 | 11 | F19_NoCPD_Day | d93111sd | - | + | - | - | - | + | + | Ref IL-SD-525 Group Larrosa_I | log_err: acqt0 not set in pulse program, result may be incorrect!, log_err: acqt0 not set in pulse program, result may be incorrect!, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0 |
| 1 | 06:59:36 | 20260831-0658-B400_B.11-1 | 10 | H1_Quant_D1_25s_Day | d93111sd | + | + | - | + | + | + | + | Ref IL-SD-525 Group Larrosa_I | |
| 25 | 01:52:36 | 20260831-0104-B400_B.11-22 | 40 | H1_Night128 | m09677nb | + | + | - | + | + | + | + | Ref 551i 3rd Group Greaney_M | |
| 24 | 01:37:44 | 20260831-0104-B400_B.11-22 | 30 | H1_Night128 | m09677nb | + | + | - | + | + | + | + | Ref 551i 2nd Group Greaney_M | |
| 23 | 01:22:14 | 20260831-0104-B400_B.11-22 | 20 | H1_Night128 | m09677nb | + | + | - | + | + | + | + | Ref 551i 1st Group Greaney_M | |
| 22 | 01:07:26 | 20260831-0104-B400_B.11-22 | 10 | H1_Night128 | m09677nb | + | + | - | + | + | + | + | Ref 550 Group Greaney_M | |
| 13 | 22:20:50 | 20260830-2206-B400_B.11-13 | 12 | B11_CPD_Day | n29715ss | + | + | - | + | + | + | + | Ref DJP-SS-newBcattet Group Procter_D | sref: NUCLEUS '11B' not defined for SOLVENT 'CDCl3' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Procter_D/data/n29715ss/nmr/20260830-2206-B400_B.11-13/12/pdata/1/peaks!, sref: NUCLEUS '11B' not defined for SOLVENT 'CDCl3' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Procter_D/data/n29715ss/nmr/20260830-2206-B400_B.11-13/12/pdata/1/peaks! |
| 13 | 22:12:50 | 20260830-2206-B400_B.11-13 | 11 | H1_B11CPD_Day | n29715ss | - | + | - | - | - | + | + | Ref DJP-SS-newBcattet Group Procter_D | |
| 13 | 22:07:29 | 20260830-2206-B400_B.11-13 | 10 | H1_Day16 | n29715ss | + | + | - | + | + | + | + | Ref DJP-SS-newBcattet Group Procter_D | |
| 5 | 19:03:51 | 20260830-1858-B400_B.11-5 | 11 | C13_CPD_Day | u67812sg | - | + | - | - | - | + | + | Ref sq-2-77-2p Group Procter_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 5 | 18:59:43 | 20260830-1858-B400_B.11-5 | 10 | H1_Day | u67812sg | + | + | - | + | + | + | + | Ref sq-2-77-2p Group Procter_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 4 | 18:57:43 | 20260830-1800-B400_B.11-4 | 4050232 | P31_NoCPD_Day | w05220ss | - | + | - | - | - | + | + | Ref JA-SiS-IV-05 Group Abbenseth_J JA-SiS-IV-05 P DEA - 31P | sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0 |
| 4 | 18:55:18 | 20260830-1800-B400_B.11-4 | 4050231 | P31_Wide_Day | w05220ss | - | + | - | - | - | + | + | Ref JA-SiS-IV-05 Group Abbenseth_J JA-SiS-IV-05 P DEA - 31P{1H} | sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0 |
| 4 | 18:49:14 | 20260830-1800-B400_B.11-4 | 4050201 | H1_Day16 | w05220ss | + | + | - | + | + | + | + | Ref JA-SiS-IV-05 Group Abbenseth_J JA-SiS-IV-05 P DEA - 1H | |
| 11 | 18:44:07 | 20260828-1908-B400_B.11-11 | 17 | H1_Day16 | x06125gb | + | + | - | + | + | + | + | Ref GCGB514LynFiltrate Group Crisenza_G | |
| 10 | 18:38:02 | 20260830-1803-B400_B.11-5 | 60 | H1_Day16 | x06125gb | + | + | - | + | + | + | + | Ref GCGB514FlushDCM Group Crisenza_G | |
| 9 | 18:31:58 | 20260830-1803-B400_B.11-5 | 50 | H1_Day16 | x06125gb | + | + | - | + | + | + | + | Ref GCGB514F79-89 Group Crisenza_G | |
| 8 | 18:25:35 | 20260830-1803-B400_B.11-5 | 40 | H1_Day16 | x06125gb | + | + | - | + | + | + | + | Ref GCGB514F67-78 Group Crisenza_G | |
| 7 | 18:19:33 | 20260830-1803-B400_B.11-5 | 30 | H1_Day16 | x06125gb | + | + | - | + | + | + | + | Ref GCGB514F26-46 Group Crisenza_G | |
| 6 | 18:14:25 | 20260830-1803-B400_B.11-5 | 20 | H1_Day16 | x06125gb | + | + | - | + | + | + | + | Ref GCGB514F9-25 Group Crisenza_G | |
| 5 | 18:07:45 | 20260830-1803-B400_B.11-5 | 10 | H1_Day16 | x06125gb | + | + | - | + | + | + | + | Ref GCGB514F8-15 Group Crisenza_G | |
| 4 | 18:02:05 | 20260830-1800-B400_B.11-4 | 4050201 | H1_Day16 | w05220ss | + | + | - | + | + | + | + | Ref JA-SiS-IV-05 Group Abbenseth_J JA-SiS-IV-05 P DEA - 1H | |
| 3 | 16:50:36 | 20260830-1601-B400_B.11-3 | 14 | H1_C13_HMBC_Night | u67812sg | - | + | - | - | - | + | + | Ref sq-2-47-14p Group Procter_D | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 3 | 16:35:15 | 20260830-1601-B400_B.11-3 | 13 | H1_C13_HSQC_Night | u67812sg | - | + | - | - | - | + | + | Ref sq-2-47-14p Group Procter_D | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 3 | 16:21:49 | 20260830-1601-B400_B.11-3 | 12 | H1_COSY_HiRes_Night | u67812sg | - | + | - | - | - | + | + | Ref sq-2-47-14p Group Procter_D | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 3 | 16:06:45 | 20260830-1601-B400_B.11-3 | 11 | C13_CPD_Night256 | u67812sg | - | + | - | - | - | + | + | Ref sq-2-47-14p Group Procter_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 3 | 16:02:10 | 20260830-1601-B400_B.11-3 | 10 | H1_Night | u67812sg | + | + | - | + | + | + | + | Ref sq-2-47-14p Group Procter_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 2 | 15:53:05 | 20260830-1546-B400_B.11-1 | 20 | H1_Day16 | d93111sd | + | + | - | + | + | + | + | Ref IL-SD2-31-d10 Group Larrosa_I | |
| 1 | 15:47:05 | 20260830-1546-B400_B.11-1 | 10 | H1_Day16 | d93111sd | + | + | - | + | + | + | + | Ref IL-SD2-31-c1 Group Larrosa_I | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 56 | 14:57:16 | 20260830-1433-B400_B.11-56 | 11 | B11_CPD_Day | n29715ss | - | + | - | - | - | + | + | Ref DJP-SS-newhydroboraton Group Procter_D | sref: NUCLEUS '11B' not defined for SOLVENT 'CDCl3' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Procter_D/data/n29715ss/nmr/20260830-1433-B400_B.11-56/11/pdata/1/peaks!, sref: NUCLEUS '11B' not defined for SOLVENT 'CDCl3' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Procter_D/data/n29715ss/nmr/20260830-1433-B400_B.11-56/11/pdata/1/peaks! |
| 56 | 14:52:01 | 20260830-1433-B400_B.11-56 | 10 | H1_Day16 | n29715ss | + | + | - | + | + | + | + | Ref DJP-SS-newhydroboraton Group Procter_D | |
| 55 | 14:50:05 | 20260830-1430-B400_B.11-54 | 4060119 | F19_NoCPD_Day | w05220ss | - | + | - | - | - | + | + | Ref JA-SiS-IV-06 Group Abbenseth_J JA-SiS-IV-06 P-CF3 - 319F | log_err: acqt0 not set in pulse program, result may be incorrect!, log_err: acqt0 not set in pulse program, result may be incorrect!, sref: NUCLEUS '19F' not defined for SOLVENT 'C6D6' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'C6D6' SR is set to 0.0 |
| 55 | 14:48:05 | 20260830-1430-B400_B.11-54 | 4060132 | P31_NoCPD_Day | w05220ss | - | + | - | - | - | + | + | Ref JA-SiS-IV-06 Group Abbenseth_J JA-SiS-IV-06 P-CF3 - 31P | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 55 | 14:46:21 | 20260830-1430-B400_B.11-54 | 4060131 | P31_Wide_Day | w05220ss | - | + | - | - | - | + | + | Ref JA-SiS-IV-06 Group Abbenseth_J JA-SiS-IV-06 P-CF3 - 31P{1H} | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 55 | 14:42:18 | 20260830-1430-B400_B.11-54 | 4060101 | H1_Day16 | w05220ss | + | + | - | + | + | + | + | Ref JA-SiS-IV-06 Group Abbenseth_J JA-SiS-IV-06 P-CF3 - 1H | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 54 | 14:40:18 | 20260830-1430-B400_B.11-54 | 4050132 | P31_NoCPD_Day | w05220ss | - | + | - | - | - | + | + | Ref JA-SiS-IV-05 Group Abbenseth_J JA-SiS-IV-05 P-DEA - 31P | sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0 |
| 54 | 14:37:20 | 20260830-1430-B400_B.11-54 | 4050131 | P31_Wide_Day | w05220ss | - | + | - | - | - | + | + | Ref JA-SiS-IV-05 Group Abbenseth_J JA-SiS-IV-05 P-DEA - 31P{1H} | sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0 |
| 54 | 14:31:37 | 20260830-1430-B400_B.11-54 | 4050101 | H1_Day16 | w05220ss | + | + | - | + | + | + | + | Ref JA-SiS-IV-05 Group Abbenseth_J JA-SiS-IV-05 P-DEA - 1H | |
| 52 | 14:17:10 | 20260830-1410-B400_B.11-52 | 10 | H1_Day16 | mbdxkrn2 | + | + | - | + | + | + | + | Ref GDB-RN Quinidine + methyl 4-bromobutanoate reaction, crude Et2O washed solid - Basic CDCl3 Group De bo_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 51 | 14:11:38 | 20260830-1410-B400_B.11-51 | 10 | H1_Day16 | mbdxkrn2 | + | + | - | + | + | + | + | Ref GDB-RN Quinidine - Basic CDCl3 Group De bo_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 5 | 11:38:57 | 20260830-1133-B400_B.11-5 | 11 | B11_CPD_Day | n29715ss | - | + | - | - | - | + | + | Ref DJP-SS-bcatnewtest Group Procter_D | sref: NUCLEUS '11B' not defined for SOLVENT 'CDCl3' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Procter_D/data/n29715ss/nmr/20260830-1133-B400_B.11-5/11/pdata/1/peaks!, sref: NUCLEUS '11B' not defined for SOLVENT 'CDCl3' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Procter_D/data/n29715ss/nmr/20260830-1133-B400_B.11-5/11/pdata/1/peaks! |
| 5 | 11:34:15 | 20260830-1133-B400_B.11-5 | 10 | H1_Day16 | n29715ss | + | + | - | + | + | + | + | Ref DJP-SS-bcatnewtest Group Procter_D | |
| 4 | 00:22:56 | 20260829-2245-B400_B.11-3 | 21 | C13_CPD_Night1024 | m09677nb | + | + | - | + | + | + | + | Ref dime no2 saturday Group Greaney_M | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 3 | 23:26:04 | 20260829-2245-B400_B.11-3 | 11 | C13_CPD_Night1024 | m09677nb | + | + | - | + | + | + | + | Ref 2ph 3me no2 saturday Group Greaney_M | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 4 | 23:02:28 | 20260829-2245-B400_B.11-3 | 20 | H1_Night128 | m09677nb | + | + | - | + | + | + | + | Ref dime no2 saturday Group Greaney_M | |
| 3 | 22:47:46 | 20260829-2245-B400_B.11-3 | 10 | H1_Night128 | m09677nb | + | + | - | + | + | + | + | Ref 2ph 3me no2 saturday Group Greaney_M | |
| 47 | 21:34:16 | 20260829-1621-B400_B.11-46 | 20 | H1_Day16 | v73981ac | + | + | - | + | + | + | + | Ref ILAC-ANG-F2-re Group Larrosa_I | |
| 46 | 20:40:31 | 20260829-1621-B400_B.11-46 | 11 | C13_CPD_Night1024 | v73981ac | - | + | - | - | - | + | + | Ref ILAC-ANG-F1-re Group Larrosa_I | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 46 | 20:35:12 | 20260829-1621-B400_B.11-46 | 10 | H1_Day16 | v73981ac | + | + | - | + | + | + | + | Ref ILAC-ANG-F1-re Group Larrosa_I | |
| 2 | 19:06:13 | 20260829-1041-B400_B.11-2 | 10 | H1_Night1024 | mbdxkrn2 | + | + | - | + | + | + | + | Ref GDB-RN-DT002-1 5 days son, after workup - DMSO-d6 Group De bo_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 12 | 19:05:49 | 20260828-1908-B400_B.11-11 | 20 | H1_Day16 | v73981ac | x | - | - | - | - | - | - | Ref IL-AC-ANG-15-F2 Group Larrosa_I | WebService Error: 103.310.145:Sample Missing Error:No sample found with Position or Tube ID '1.12'. |
| 11 | 19:05:07 | 20260828-1908-B400_B.11-11 | 10 | H1_Day16 | v73981ac | - | - | - | - | - | - | - | Ref IL-AC-ANG-15-F1 Group Larrosa_I | |
| 45 | 18:58:40 | 20260828-1850-B400_B.11-45 | 10 | H1_WaterSupp_Day | f56027ch | + | + | - | + | + | + | + | Ref 20260826 Cu(datrz) air 1mg -1.5v-2 new Group Schroder_M | |
| 44 | 18:51:49 | 20260828-1850-B400_B.11-44 | 10 | H1_WaterSupp_Day | f56027ch | + | + | - | + | + | + | + | Ref 20260826 Cu(datrz) air 1mg -1.5v new Group Schroder_M | |
| 43 | 18:45:13 | 20260828-1850-B400_B.11-43 | 10 | H1_WaterSupp_Day | f56027ch | + | + | - | + | + | + | + | Ref 20260826 Cu(datrz) air 1mg -1.4v new Group Schroder_M | |
| 42 | 18:38:48 | 20260828-1850-B400_B.11-42 | 10 | H1_WaterSupp_Day | f56027ch | + | + | - | + | + | + | + | Ref 20260826 Cu(datrz) air 1mg -1.3v new Group Schroder_M | |
| 41 | 18:32:24 | 20260828-1850-B400_B.11-41 | 10 | H1_WaterSupp_Day | f56027ch | + | + | - | + | + | + | + | Ref 20260826 Cu(datrz) N2 1mg -1.5v new Group Schroder_M | |
| 40 | 18:26:03 | 20260828-1850-B400_B.11-40 | 10 | H1_WaterSupp_Day | f56027ch | + | + | - | + | + | + | + | Ref 20260826 Cu(datrz) N2 1mg -1.4v new Group Schroder_M | |
| 39 | 17:50:28 | 20260828-1850-B400_B.11-39 | 10 | H1_WaterSupp_Night | f56027ch | + | + | - | + | + | + | + | Ref 20260826 Cu(datrz) N2 1mg -1.3v new Group Schroder_M | |
| 38 | 17:15:12 | 20260828-1850-B400_B.11-38 | 10 | H1_WaterSupp_Night | f56027ch | + | + | - | + | + | + | + | Ref 20260826 Cu(datrz) air 5mg -1.2v Group Schroder_M | |
| 37 | 16:39:51 | 20260828-1850-B400_B.11-37 | 10 | H1_WaterSupp_Night | f56027ch | + | + | - | + | + | + | + | Ref 20260826 Cu(datrz) air 5mg -1.1v Group Schroder_M | |
| 36 | 16:04:31 | 20260828-1850-B400_B.11-36 | 10 | H1_WaterSupp_Night | f56027ch | + | + | - | + | + | + | + | Ref 20260826 Cu(datrz) air 5mg -1.0v Group Schroder_M | |
| 35 | 15:29:17 | 20260828-1850-B400_B.11-35 | 10 | H1_WaterSupp_Night | f56027ch | + | + | - | + | + | + | + | Ref 20260826 Cu(datrz) air 5mg -0.9v Group Schroder_M | |
| 34 | 14:53:03 | 20260828-1850-B400_B.11-34 | 10 | H1_WaterSupp_Night | f56027ch | + | + | - | + | + | + | + | Ref 20260826 Cu(datrz) air 5mg -0.8v Group Schroder_M | |
| 6 | 14:25:48 | 20260828-1827-B400_B.11-6 | 12 | C13_DEPT135_Night | m52750pm | - | + | - | - | - | + | + | Ref GCPM393cr-D Group Crisenza_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 6 | 14:10:44 | 20260828-1827-B400_B.11-6 | 11 | C13_CPD_Night256 | m52750pm | - | + | - | - | - | + | + | Ref GCPM393cr-C Group Crisenza_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 6 | 14:06:26 | 20260828-1827-B400_B.11-6 | 10 | H1_Night | m52750pm | + | + | - | + | + | + | + | Ref GCPM393cr-H Group Crisenza_G | |
| 55 | 14:01:31 | 20260828-1822-B400_B.11-55 | 10 | H1_Day | k02620dc | + | + | - | + | + | + | + | Ref DC-MFAT-LD-rt-wu Group Leigh_D | |
| 29 | 13:36:26 | 20260828-1612-B400_B.11-29 | 15 | P31_NoCPD_Night | p27065cs | - | + | - | - | - | + | + | Ref CS39_2 Group Goodwin_C | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 29 | 13:10:48 | 20260828-1612-B400_B.11-29 | 14 | P31_CPD_Night | p27065cs | - | + | - | - | - | + | + | Ref CS39_2 Group Goodwin_C | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 29 | 12:57:27 | 20260828-1612-B400_B.11-29 | 13 | H1_Night128 | p27065cs | + | + | - | + | + | + | + | Ref CS39_2 Group Goodwin_C | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 26 | 12:32:23 | 20260828-1609-B400_B.11-26 | 15 | P31_NoCPD_Night | p27065cs | - | + | - | - | - | + | + | Ref CS_34_3 Group Goodwin_C | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 26 | 12:04:26 | 20260828-1609-B400_B.11-26 | 14 | P31_CPD_Night | p27065cs | + | + | - | + | + | + | + | Ref CS_34_3 Group Goodwin_C | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 5 | 11:37:07 | 20260828-1233-B400_B.11-5 | 15 | C13_DEPTQ_Night | x06125gb | - | + | - | - | - | + | + | Ref GCGB513PrandCy Group Crisenza_G | |
| 5 | 10:58:24 | 20260828-1233-B400_B.11-5 | 14 | H1_C13_HMBC_Night | x06125gb | + | + | - | + | + | + | + | Ref GCGB513PrandCy Group Crisenza_G | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 60 | 09:29:29 | 20260828-0827-B400_B.11-60 | 11 | H1_Night1024 | mbdxkrn2 | + | + | - | + | + | + | + | Ref GDB-RN-DT002-1 5 days son, MeCN wash phase from crude material - DMSO-d6 Group De bo_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 4 | 09:28:07 | 20260828-1226-B400_B.11-4 | 4020406 | H1_P31CPD_Day | w05220ss | - | + | - | - | - | + | + | Ref JA-SiS-IV-02 Group Abbenseth_J JA-SiS-IV-02 P=NPhOMe - 1H{31P} | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 4 | 09:26:07 | 20260828-1226-B400_B.11-4 | 4020432 | P31_NoCPD_Day | w05220ss | - | + | - | - | - | + | + | Ref JA-SiS-IV-02 Group Abbenseth_J JA-SiS-IV-02 P=NPhOMe - 31P | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 4 | 09:23:44 | 20260828-1226-B400_B.11-4 | 4020431 | P31_Wide_Day | w05220ss | - | + | - | - | - | + | + | Ref JA-SiS-IV-02 Group Abbenseth_J JA-SiS-IV-02 P=NPhOMe - 31P{1H} | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 4 | 08:48:35 | 20260828-1226-B400_B.11-4 | 4020405 | H1_C13_HMBC_Night | w05220ss | - | + | - | - | - | + | + | Ref JA-SiS-IV-02 Group Abbenseth_J JA-SiS-IV-02 P=NPhOMe - HMBC | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 4 | 08:33:12 | 20260828-1226-B400_B.11-4 | 4020404 | H1_C13_HSQC_Night | w05220ss | - | + | - | - | - | + | + | Ref JA-SiS-IV-02 Group Abbenseth_J JA-SiS-IV-02 P=NPhOMe - HSQC | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 4 | 08:19:43 | 20260828-1226-B400_B.11-4 | 4020403 | H1_COSY_HiRes_Night | w05220ss | - | + | - | - | - | + | + | Ref JA-SiS-IV-02 Group Abbenseth_J JA-SiS-IV-02 P=NPhOMe - COSY | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 4 | 07:23:27 | 20260828-1226-B400_B.11-4 | 4020402 | C13_CPD_Night1024 | w05220ss | + | + | - | + | + | + | + | Ref JA-SiS-IV-02 Group Abbenseth_J JA-SiS-IV-02 P=NPhOMe - 13C{1H} | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 19 | 22:16:12 | 20260828-2127-B400_B.11-19 | 10 | H1_Night128 | f11141tm | + | + | - | x | - | - | - | Ref Cu(Salen)-La acetone reduction 2mA Group Yang_S | Lock failed after multiple attempts, lock: Command 'lock CDCl3' failed. Lock is OFF, Command 'lock CDCl3' failed. Lock is OFF |
| 18 | 22:12:43 | 20260828-2127-B400_B.11-18 | 10 | H1_Night128 | f11141tm | + | + | - | x | - | - | - | Ref Cu(Salen)-Mn acetone reduction 5mA Group Yang_S | Lock failed after multiple attempts, lock: Command 'lock CDCl3' failed. Lock is OFF, Command 'lock CDCl3' failed. Lock is OFF |
| 17 | 22:09:32 | 20260828-2126-B400_B.11-17 | 10 | H1_Night128 | f11141tm | - | - | - | - | - | - | - | Ref Cu(Salen)-Mn acetone reduction 2mA Group Yang_S | |
| 13 | 21:54:09 | 20260828-2007-B400_B.11-13 | 10 | H1_Night128 | k02620dc | + | + | - | + | + | + | + | Ref DC-mfat-1meoh-tlc-f3 Group Leigh_D | |
| 10 | 21:39:02 | 20260828-2007-B400_B.11-10 | 10 | H1_Night128 | k02620dc | + | + | - | + | + | + | + | Ref DC-mfat-1meoh-tlc-f2 Group Leigh_D | |
| 9 | 21:24:34 | 20260828-2006-B400_B.11-9 | 10 | H1_Night128 | k02620dc | + | + | - | + | + | + | + | Ref DC-mfat-1meoh-tlc-f1 Group Leigh_D | |
| 8 | 21:09:40 | 20260828-2006-B400_B.11-8 | 10 | H1_Night128 | k02620dc | + | + | - | + | + | + | + | Ref DC-mfat-5meoh-tlc-f2 Group Leigh_D | |
| 7 | 20:54:47 | 20260828-2005-B400_B.11-7 | 10 | H1_Night128 | k02620dc | + | + | - | + | + | + | + | Ref DC-mfat-5meoh-tlc-f3 Group Leigh_D | |
| 3 | 19:57:50 | 20260827-1943-B400_B.11-2 | 21 | C13_CPD_Night1024 | m09677nb | + | + | - | + | + | + | + | Ref 2ph 3me no2 Group Greaney_M | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 10 | 19:52:28 | 20260828-1859-B400_B.11-7 | 40 | H1_Day16 | x06125gb | + | + | - | + | + | + | + | Ref GCGB514Flush Group Crisenza_G | |
| 9 | 19:46:32 | 20260828-1859-B400_B.11-7 | 30 | H1_Day16 | x06125gb | + | + | - | + | + | + | + | Ref GCGB514F47-66 Group Crisenza_G | |
| 8 | 19:41:05 | 20260828-1859-B400_B.11-7 | 20 | H1_Day16 | x06125gb | + | + | - | + | + | + | + | Ref GCGB514F16-19 Group Crisenza_G | |
| 7 | 19:36:00 | 20260828-1859-B400_B.11-7 | 10 | H1_Day16 | x06125gb | + | + | - | + | + | + | + | Ref GCGB514F4-7 Group Crisenza_G | |
| 2 | 18:38:00 | 20260827-1943-B400_B.11-2 | 11 | C13_CPD_Night1024 | m09677nb | + | + | - | + | + | + | + | Ref dime no2 Group Greaney_M | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 54 | 18:24:31 | 20260828-1802-B400_B.11-54 | 12 | H1_COSY_HiRes_Night | j45108ph | - | + | - | - | - | + | + | Ref ph-742-3rd-red-gpc Group Leigh_D knot | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 54 | 18:20:05 | 20260828-1802-B400_B.11-54 | 11 | H1_Night | j45108ph | + | + | - | + | + | + | + | Ref ph-742-3rd-red-gpc Group Leigh_D knot | |
| 56 | 18:16:37 | 20260828-1803-B400_B.11-56 | 10 | H1_Day | j45108ph | + | + | - | + | + | + | + | Ref alf-202 Group Leigh_D 28 aug night | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 55 | 18:09:52 | 20260828-1802-B400_B.11-55 | 10 | H1_Day | j45108ph | + | + | - | + | + | + | + | Ref ph-742-red-dcm Group Leigh_D 0.77 mg knot in dcm-d2 | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 54 | 18:06:18 | 20260828-1802-B400_B.11-54 | 10 | H1_Day | j45108ph | + | + | - | + | + | + | + | Ref ph-742-3rd-red-gpc Group Leigh_D knot | |
| 50 | 17:30:20 | 20260827-2117-B400_B.11-47 | 30 | H1_WaterSupp_Night | f11141tm | + | + | - | + | + | + | + | Ref Cu(Salen)-Mn HCONH2 1.4V 30min Group Yang_S | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 26 | 17:26:17 | 20260828-1609-B400_B.11-26 | 13 | H1_Night | p27065cs | + | + | - | + | + | + | + | Ref CS_34_3 Group Goodwin_C | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 21 | 17:25:49 | 20260828-1653-B400_B.11-21 | 10 | H1_Day16 | d08103sl | - | - | - | - | - | - | - | Ref sl-se-13 Group Leigh_D | |
| 20 | 17:21:16 | 20260828-1651-B400_B.11-20 | 10 | H1_Day | m19368jb | + | + | - | + | + | + | + | Ref AK-JB119C Group Keerthi_A | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 19 | 17:16:06 | 20260828-1643-B400_B.11-17 | 30 | H1_Day16 | x06125gb | + | + | - | + | + | + | + | Ref GCGB509F1 Group Crisenza_G | |
| 18 | 17:10:59 | 20260828-1643-B400_B.11-17 | 20 | H1_Day16 | x06125gb | + | + | - | + | + | + | + | Ref GCGB513F16-34 Group Crisenza_G | |
| 17 | 17:05:37 | 20260828-1643-B400_B.11-17 | 10 | H1_Day16 | x06125gb | + | + | - | + | + | + | + | Ref GCGB513F3-15 Group Crisenza_G | |
| 16 | 16:59:22 | 20260824-1446-B400_B.11-16 | 11 | H1_Day16 | d08103sl | + | + | - | + | + | + | + | Ref sl-se-13 Group Leigh_D | |
| 15 | 16:54:14 | 20260828-1632-B400_B.11-15 | 12 | Si29_DEPT90_Day | m69065je | - | + | - | - | - | + | + | Ref JEK698_vacd_htd Group Mills_D JEK698_vacd_htd | sref: NUCLEUS '29Si' not defined for SOLVENT 'C6D6' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Mills_D/data/m69065je/nmr/20260828-1632-B400_B.11-15/12/pdata/1/peaks!, sref: NUCLEUS '29Si' not defined for SOLVENT 'C6D6' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Mills_D/data/m69065je/nmr/20260828-1632-B400_B.11-15/12/pdata/1/peaks! |
| 15 | 16:52:25 | 20260828-1632-B400_B.11-15 | 11 | B11_NoCPD_Day | m69065je | - | + | - | - | - | + | + | Ref JEK698_vacd_htd Group Mills_D JEK698_vacd_htd | log_err: acqt0 not set in pulse program, result may be incorrect!, log_err: acqt0 not set in pulse program, result may be incorrect!, sref: NUCLEUS '11B' not defined for SOLVENT 'C6D6' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Mills_D/data/m69065je/nmr/20260828-1632-B400_B.11-15/11/pdata/1/peaks!, sref: NUCLEUS '11B' not defined for SOLVENT 'C6D6' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Mills_D/data/m69065je/nmr/20260828-1632-B400_B.11-15/11/pdata/1/peaks! |
| 15 | 16:48:29 | 20260828-1632-B400_B.11-15 | 10 | H1_Day16 | m69065je | + | + | - | + | + | + | + | Ref JEK698_vacd_htd Group Mills_D JEK698_vacd_htd | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 14 | 16:43:09 | 20260828-1632-B400_B.11-14 | 12 | Si29_DEPT90_Day | m69065je | - | + | - | - | - | + | + | Ref JEK697_vacd_htd Group Mills_D JEK697_vacd_htd | sref: NUCLEUS '29Si' not defined for SOLVENT 'C6D6' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Mills_D/data/m69065je/nmr/20260828-1632-B400_B.11-14/12/pdata/1/peaks!, sref: NUCLEUS '29Si' not defined for SOLVENT 'C6D6' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Mills_D/data/m69065je/nmr/20260828-1632-B400_B.11-14/12/pdata/1/peaks! |
| 14 | 16:40:53 | 20260828-1632-B400_B.11-14 | 11 | B11_NoCPD_Day | m69065je | - | + | - | - | - | + | + | Ref JEK697_vacd_htd Group Mills_D JEK697_vacd_htd | log_err: acqt0 not set in pulse program, result may be incorrect!, log_err: acqt0 not set in pulse program, result may be incorrect!, sref: NUCLEUS '11B' not defined for SOLVENT 'C6D6' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Mills_D/data/m69065je/nmr/20260828-1632-B400_B.11-14/11/pdata/1/peaks!, sref: NUCLEUS '11B' not defined for SOLVENT 'C6D6' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Mills_D/data/m69065je/nmr/20260828-1632-B400_B.11-14/11/pdata/1/peaks! |
| 14 | 16:36:43 | 20260828-1632-B400_B.11-14 | 10 | H1_Day16 | m69065je | + | + | - | + | + | + | + | Ref JEK697_vacd_htd Group Mills_D JEK697_vacd_htd | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 31 | 16:33:05 | 20260828-1622-B400_B.11-31 | 10 | H1_Day | j82494jb | + | + | - | + | + | + | + | Ref QBB-G147-2hrs Group Leigh_D | |
| 30 | 16:27:20 | 20260828-1614-B400_B.11-30 | 10 | H1_Day16 | h32367lm | + | + | - | + | + | + | + | Ref LM_FMac_H2 Group Leigh_D | |
| 29 | 16:25:20 | 20260828-1612-B400_B.11-29 | 12 | P31_NoCPD_Day | p27065cs | - | + | - | - | - | + | + | Ref CS39_1 Group Goodwin_C | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 29 | 16:23:35 | 20260828-1612-B400_B.11-29 | 11 | P31_CPD_Day | p27065cs | - | + | - | - | - | + | + | Ref CS39_1 Group Goodwin_C | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 29 | 16:19:22 | 20260828-1612-B400_B.11-29 | 10 | H1_Day16 | p27065cs | + | + | - | + | + | + | + | Ref CS39_1 Group Goodwin_C | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 26 | 16:17:21 | 20260828-1609-B400_B.11-26 | 12 | P31_NoCPD_Day | p27065cs | - | + | - | - | - | + | + | Ref CS_34_2 Group Goodwin_C | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 26 | 16:15:37 | 20260828-1609-B400_B.11-26 | 11 | P31_CPD_Day | p27065cs | - | + | - | - | - | + | + | Ref CS_34_2 Group Goodwin_C | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 26 | 16:11:24 | 20260828-1609-B400_B.11-26 | 10 | H1_Day16 | p27065cs | + | + | - | + | + | + | + | Ref CS_34_2 Group Goodwin_C | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 25 | 16:06:32 | 20260828-1425-B400_B.11-25 | 10 | H1_Day | e31374yl | + | + | - | + | + | + | + | Ref 5kp Group Saunders_B | |
| 24 | 16:02:28 | 20260828-1425-B400_B.11-24 | 10 | H1_Day | e31374yl | + | + | - | + | + | + | + | Ref 5cp Group Saunders_B | |
| 23 | 15:58:53 | 20260828-1425-B400_B.11-23 | 10 | H1_Day | e31374yl | + | + | - | + | + | + | + | Ref 1cp Group Saunders_B | |
| 22 | 15:54:38 | 20260828-1422-B400_B.11-22 | 10 | H1_Day | e31374yl | + | + | - | + | + | + | + | Ref pla Group Saunders_B | |
| 8 | 15:50:32 | 20260828-1525-B400_B.11-8 | 10 | H1_Day | z88883sp | + | + | - | + | + | + | + | Ref SP427h2 Group Romanov_A | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 7 | 15:48:32 | 20260828-1418-B400_B.11-7 | 3670332 | P31_NoCPD_Day | w05220ss | - | + | - | - | - | + | + | Ref JA-SiS-III-67 Group Abbenseth_J JA-SiS-III-67 PNH3 yellow solid from pentatne solw evp - 31P | sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0 |
| 7 | 15:46:43 | 20260828-1418-B400_B.11-7 | 3670331 | P31_Wide_Day | w05220ss | - | + | - | - | - | + | + | Ref JA-SiS-III-67 Group Abbenseth_J JA-SiS-III-67 PNH3 yellow solid from pentatne solw evp - 31P{1H} | sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0 |
| 7 | 15:40:40 | 20260828-1418-B400_B.11-7 | 3670301 | H1_Day16 | w05220ss | + | + | - | + | + | + | + | Ref JA-SiS-III-67 Group Abbenseth_J JA-SiS-III-67 PNH3 yellow solid from pentatne solw evp - 1H | |
| 8 | 15:26:51 | 20260828-1525-B400_B.11-8 | 10 | H1_Day | z88883sp | + | + | - | + | - | - | - | Ref SP427h2 Group Romanov_A | Automation was stopped by user |
| 7 | 15:26:19 | 20260828-1418-B400_B.11-7 | 3670332 | P31_NoCPD_Day | w05220ss | - | + | - | - | - | x | - | Ref JA-SiS-III-67 Group Abbenseth_J JA-SiS-III-67 PNH3 yellow solid from pentatne solw evp - 31P | |
| 7 | 15:24:49 | 20260828-1418-B400_B.11-7 | 3670331 | P31_Wide_Day | w05220ss | - | + | - | - | - | x | - | Ref JA-SiS-III-67 Group Abbenseth_J JA-SiS-III-67 PNH3 yellow solid from pentatne solw evp - 31P{1H} | |
| 7 | 14:20:22 | 20260828-1418-B400_B.11-7 | 3670301 | H1_Day16 | w05220ss | + | + | - | + | + | + | + | Ref JA-SiS-III-67 Group Abbenseth_J JA-SiS-III-67 PNH3 yellow solid from pentatne solw evp - 1H | |
| 6 | 14:09:51 | 20260828-1403-B400_B.11-6 | 10 | H1_Day16 | h32367lm | + | + | - | + | + | + | + | Ref LM_FMac_mcpba_16-18 Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 5 | 13:54:30 | 20260828-1233-B400_B.11-5 | 13 | H1_C13_HSQC_Night | x06125gb | - | + | - | - | - | + | + | Ref GCGB513PrandCy Group Crisenza_G | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 5 | 13:41:03 | 20260828-1233-B400_B.11-5 | 12 | H1_COSY_HiRes_Night | x06125gb | - | + | - | - | - | + | + | Ref GCGB513PrandCy Group Crisenza_G | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 5 | 13:26:30 | 20260828-1233-B400_B.11-5 | 11 | C13_CPD_Night256 | x06125gb | - | + | - | - | - | + | + | Ref GCGB513PrandCy Group Crisenza_G | |
| 5 | 13:21:07 | 20260828-1233-B400_B.11-5 | 10 | H1_Night | x06125gb | + | + | - | + | + | + | + | Ref GCGB513PrandCy Group Crisenza_G | |
| 4 | 13:16:27 | 20260828-1226-B400_B.11-4 | 4020401 | H1_Night | w05220ss | + | + | - | + | + | + | + | Ref JA-SiS-IV-02 Group Abbenseth_J JA-SiS-IV-02 P=NPhOMe - 1H | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 21 | 13:13:11 | 20260828-1309-B400_B.11-21 | 10 | H1_Day | z92209cg | + | + | - | + | + | + | + | Ref ALF202 fuelled 1d Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 20 | 13:09:59 | 20260828-1225-B400_B.11-20 | 10 | H1_Day | z92209cg | + | + | - | + | + | + | + | Ref ALF197 2 fuelled 6d Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 19 | 13:06:56 | 20260828-1224-B400_B.11-19 | 10 | H1_Day | z92209cg | + | + | - | + | + | + | + | Ref ALF196 2 fuelled 6d Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 18 | 13:03:49 | 20260828-1224-B400_B.11-18 | 10 | H1_Day | z92209cg | + | + | - | + | + | + | + | Ref ALF195 2 fuelled 6d Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 17 | 13:00:02 | 20260828-1222-B400_B.11-17 | 10 | H1_Day | z92209cg | + | + | - | + | + | + | + | Ref ALF194 2 fuelled 6d Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 12 | 12:57:59 | 20260828-1217-B400_B.11-10 | 31 | F19_NoCPD_Day | j40457bh | - | + | - | - | - | + | + | Ref bhno17i Group Trowbridge_A | log_err: acqt0 not set in pulse program, result may be incorrect!, log_err: acqt0 not set in pulse program, result may be incorrect!, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0 |
| 12 | 12:52:22 | 20260828-1217-B400_B.11-10 | 30 | H1_Day | j40457bh | + | + | - | + | + | + | + | Ref bhno17i Group Trowbridge_A | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 11 | 12:50:19 | 20260828-1217-B400_B.11-10 | 21 | F19_NoCPD_Day | j40457bh | - | + | - | - | - | + | + | Ref bhno17g Group Trowbridge_A | log_err: acqt0 not set in pulse program, result may be incorrect!, log_err: acqt0 not set in pulse program, result may be incorrect!, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0 |
| 11 | 12:46:24 | 20260828-1217-B400_B.11-10 | 20 | H1_Day | j40457bh | + | + | - | + | + | + | + | Ref bhno17g Group Trowbridge_A | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 10 | 12:44:21 | 20260828-1217-B400_B.11-10 | 11 | F19_NoCPD_Day | j40457bh | - | + | - | - | - | + | + | Ref bhno17e Group Trowbridge_A | log_err: acqt0 not set in pulse program, result may be incorrect!, log_err: acqt0 not set in pulse program, result may be incorrect!, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0 |
| 10 | 12:39:12 | 20260828-1217-B400_B.11-10 | 10 | H1_Day | j40457bh | + | + | - | + | + | + | + | Ref bhno17e Group Trowbridge_A | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 6 | 12:35:35 | 20260828-1215-B400_B.11-4 | 31 | F19_NoCPD_Day | j40457bh | - | + | - | - | - | + | + | Ref bhno17d Group Trowbridge_A | log_err: acqt0 not set in pulse program, result may be incorrect!, log_err: acqt0 not set in pulse program, result may be incorrect!, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0 |
| 6 | 12:30:58 | 20260828-1215-B400_B.11-4 | 30 | H1_Day | j40457bh | + | + | - | + | + | + | + | Ref bhno17d Group Trowbridge_A | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 5 | 12:28:56 | 20260828-1215-B400_B.11-4 | 21 | F19_NoCPD_Day | j40457bh | - | + | - | - | - | + | + | Ref bhno17c Group Trowbridge_A | log_err: acqt0 not set in pulse program, result may be incorrect!, log_err: acqt0 not set in pulse program, result may be incorrect!, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0 |
| 5 | 12:23:59 | 20260828-1215-B400_B.11-4 | 20 | H1_Day | j40457bh | + | + | - | + | + | + | + | Ref bhno17c Group Trowbridge_A | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 4 | 12:21:52 | 20260828-1215-B400_B.11-4 | 11 | F19_NoCPD_Day | j40457bh | - | + | - | - | - | + | + | Ref bhno17a Group Trowbridge_A | log_err: acqt0 not set in pulse program, result may be incorrect!, log_err: acqt0 not set in pulse program, result may be incorrect!, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0 |
| 4 | 12:17:30 | 20260828-1215-B400_B.11-4 | 10 | H1_Day | j40457bh | + | + | - | + | + | + | + | Ref bhno17a Group Trowbridge_A | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 46 | 12:12:33 | 20260828-1201-B400_B.11-46 | 4020332 | P31_NoCPD_Day | w05220ss | - | + | - | - | - | + | + | Ref JA-SiS-IV-02 Group Abbenseth_J JA-SiS-IV-02 P=NPhOMe - white preciipitate - 31P | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 46 | 12:09:29 | 20260828-1201-B400_B.11-46 | 4020331 | P31_Wide_Day | w05220ss | - | + | - | - | - | + | + | Ref JA-SiS-IV-02 Group Abbenseth_J JA-SiS-IV-02 P=NPhOMe - white preciipitate - 31P{1H} | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 46 | 12:05:00 | 20260828-1201-B400_B.11-46 | 4020301 | H1_Day16 | w05220ss | + | + | - | + | + | + | + | Ref JA-SiS-IV-02 Group Abbenseth_J JA-SiS-IV-02 P=NPhOMe - white preciipitate - 1H | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 45 | 11:59:24 | 20260828-1110-B400_B.11-37 | 30 | H1_Day16 | h32367lm | + | + | - | + | + | + | + | Ref LM_FMac_30_mCPBA Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 44 | 11:50:17 | 20260828-1140-B400_B.11-44 | 10 | H1_Day | z88883sp | + | + | - | + | + | + | + | Ref SP439p2 Group Romanov_A Sublimation late orange amorphous | |
| 43 | 11:45:50 | 20260828-1139-B400_B.11-43 | 10 | H1_Day | z88883sp | + | + | - | + | + | + | + | Ref SP439p1 Group Romanov_A Sublimation early yellow microcryst | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 42 | 11:39:01 | 20260828-1135-B400_B.11-42 | 10 | H1_Day16 | k48162ck | + | + | - | + | + | + | + | Ref au-acetylene Group Romanov_A | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 41 | 11:33:29 | 20260828-1110-B400_B.11-37 | 20 | H1_Day16 | h32367lm | + | + | - | + | + | + | + | Ref LM_FMac_30_mCPBA Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 40 | 11:29:48 | 20260828-1102-B400_B.11-40 | 10 | H1_Day | c15276ec | + | + | - | + | + | + | + | Ref exc253-background-bulky-kcl Group Leigh_D exc253-background-bulky-kcl | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 39 | 11:25:55 | 20260828-1102-B400_B.11-39 | 10 | H1_Day | c15276ec | + | + | - | + | + | + | + | Ref exc253-background-bulky-nacl Group Leigh_D exc253-background-bulky-nacl | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 38 | 11:21:17 | 20260828-1102-B400_B.11-38 | 10 | H1_Day | c15276ec | + | + | - | + | + | + | + | Ref exc253-background-bulky-nosalt Group Leigh_D exc253-background-bulky-nosalt | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 37 | 11:15:26 | 20260828-1110-B400_B.11-37 | 10 | H1_Day16 | h32367lm | + | + | - | + | + | + | + | Ref LM_FMac_30_mCPBA Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 36 | 11:11:31 | 20260828-1101-B400_B.11-36 | 10 | H1_Day | c15276ec | + | + | - | + | + | + | + | Ref exc252-bulkyfuel-kcl-30-12 Group Leigh_D exc252-bulkyfuel-kcl-30-12 | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 35 | 11:07:50 | 20260828-1101-B400_B.11-35 | 10 | H1_Day | c15276ec | + | + | - | + | + | + | + | Ref exc252-bulkyfuel-nacl-30-12 Group Leigh_D exc252-bulkyfuel-nacl-30-12 | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 34 | 11:04:00 | 20260828-1101-B400_B.11-34 | 10 | H1_Day | c15276ec | + | + | - | + | + | + | + | Ref exc252-bulkyfuel-nosalt-30-12 Group Leigh_D exc252-bulkyfuel-nosalt-30-12 | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 31 | 10:59:29 | 20260828-1058-B400_B.11-31 | 10 | H1_Day | c15276ec | + | + | - | + | + | + | + | Ref exc258-stepwise-dimethoxymotor-hydrolysis-3 Group Leigh_D exc258-stepwise-dimethoxymotor-hydrolysis-3 | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 9 | 10:19:59 | 20260827-2039-B400_B.11-9 | 11 | B11_NoCPD_Day | q50682hk | + | + | - | + | + | + | + | Ref HK-DW-161 boron Group Willcox_D | log_err: acqt0 not set in pulse program, result may be incorrect!, log_err: acqt0 not set in pulse program, result may be incorrect!, sref: NUCLEUS '11B' not defined for SOLVENT 'CD2Cl2' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Willcox_D/data/q50682hk/nmr/20260827-2039-B400_B.11-9/11/pdata/1/peaks!, sref: NUCLEUS '11B' not defined for SOLVENT 'CD2Cl2' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Willcox_D/data/q50682hk/nmr/20260827-2039-B400_B.11-9/11/pdata/1/peaks! |
| 8 | 10:18:42 | 20260828-0950-B400_B.11-8 | 11 | B11_NoCPD_Day | q50682hk | - | + | - | - | - | + | + | Ref HK-DW-152 pF BE boron Group Willcox_D | log_err: acqt0 not set in pulse program, result may be incorrect!, log_err: acqt0 not set in pulse program, result may be incorrect!, sref: NUCLEUS '11B' not defined for SOLVENT 'CD2Cl2' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Willcox_D/data/q50682hk/nmr/20260828-0950-B400_B.11-8/11/pdata/1/peaks!, sref: NUCLEUS '11B' not defined for SOLVENT 'CD2Cl2' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Willcox_D/data/q50682hk/nmr/20260828-0950-B400_B.11-8/11/pdata/1/peaks! |
| 8 | 10:13:46 | 20260828-0950-B400_B.11-8 | 10 | B11_CPD_Day | q50682hk | + | + | - | + | + | + | + | Ref HK-DW-152 pF BE boron Group Willcox_D | sref: NUCLEUS '11B' not defined for SOLVENT 'CD2Cl2' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Willcox_D/data/q50682hk/nmr/20260828-0950-B400_B.11-8/10/pdata/1/peaks!, sref: NUCLEUS '11B' not defined for SOLVENT 'CD2Cl2' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Willcox_D/data/q50682hk/nmr/20260828-0950-B400_B.11-8/10/pdata/1/peaks! |
| 5 | 10:11:51 | 20260828-0949-B400_B.11-5 | 11 | B11_CPD_Day | q50682hk | - | + | - | - | - | + | + | Ref HK-DW-153 CF3 BE bor Group Willcox_D | sref: NUCLEUS '11B' not defined for SOLVENT 'CD2Cl2' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Willcox_D/data/q50682hk/nmr/20260828-0949-B400_B.11-5/11/pdata/1/peaks!, sref: NUCLEUS '11B' not defined for SOLVENT 'CD2Cl2' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Willcox_D/data/q50682hk/nmr/20260828-0949-B400_B.11-5/11/pdata/1/peaks! |
| 5 | 10:06:24 | 20260828-0949-B400_B.11-5 | 10 | B11_NoCPD_Day | q50682hk | + | + | - | + | + | + | + | Ref HK-DW-153 CF3 BE bor Group Willcox_D | log_err: acqt0 not set in pulse program, result may be incorrect!, log_err: acqt0 not set in pulse program, result may be incorrect!, sref: NUCLEUS '11B' not defined for SOLVENT 'CD2Cl2' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Willcox_D/data/q50682hk/nmr/20260828-0949-B400_B.11-5/10/pdata/1/peaks!, sref: NUCLEUS '11B' not defined for SOLVENT 'CD2Cl2' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Willcox_D/data/q50682hk/nmr/20260828-0949-B400_B.11-5/10/pdata/1/peaks! |
| 4 | 10:00:13 | 20260828-0948-B400_B.11-4 | 10 | B11_NoCPD_Day | q50682hk | + | + | - | + | x | + | + | Ref HK-DW-162 bor Group Willcox_D | topshim: TopshimPerformShimming - too many points lost during fit, Shim failed, log_err: acqt0 not set in pulse program, result may be incorrect!, log_err: acqt0 not set in pulse program, result may be incorrect!, sref: NUCLEUS '11B' not defined for SOLVENT 'CD2Cl2' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Willcox_D/data/q50682hk/nmr/20260828-0948-B400_B.11-4/10/pdata/1/peaks!, sref: NUCLEUS '11B' not defined for SOLVENT 'CD2Cl2' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Willcox_D/data/q50682hk/nmr/20260828-0948-B400_B.11-4/10/pdata/1/peaks! |
| 1 | 09:54:10 | 20260828-0947-B400_B.11-1 | 10 | B11_NoCPD_Day | q50682hk | + | + | - | + | x | + | + | Ref HK-DW-158 fex boron Group Willcox_D | topshim: pushParameters - writing parameters from BSMS buffer to BSMS failed - error in BsmsControl::pushParameters: SI_5 : Parameter is out of static range, Shim failed, log_err: acqt0 not set in pulse program, result may be incorrect!, log_err: acqt0 not set in pulse program, result may be incorrect!, sref: NUCLEUS '11B' not defined for SOLVENT 'CD2Cl2' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Willcox_D/data/q50682hk/nmr/20260828-0947-B400_B.11-1/10/pdata/1/peaks!, sref: NUCLEUS '11B' not defined for SOLVENT 'CD2Cl2' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Willcox_D/data/q50682hk/nmr/20260828-0947-B400_B.11-1/10/pdata/1/peaks! |
| 60 | 09:40:45 | 20260828-0827-B400_B.11-60 | 10 | H1_Night128 | mbdxkrn2 | + | + | - | + | + | + | + | Ref GDB-RN-DT002-1 5 days son, MeCN wash phase from crude material - DMSO-d6 Group De bo_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 59 | 09:26:41 | 20260828-0826-B400_B.11-59 | 10 | H1_Night128 | mbdxkrn2 | + | + | - | + | + | + | + | Ref GDB-RN-DT002-1 5 days son, MeCN-washed crude material - DMSO-d6 Group De bo_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 5 | 09:24:06 | 20260828-0832-B400_B.11-5 | 2 | C13_CPD_Day | w05220ss | - | + | - | - | - | + | + | Ref JA-SiS-DNPA Group Abbenseth_J DNPA C6D6 | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 5 | 09:19:58 | 20260828-0832-B400_B.11-5 | 1 | H1_Day16 | w05220ss | + | + | - | + | + | + | + | Ref JA-SiS-DNPA Group Abbenseth_J DNPA C6D6 | |
| 4 | 09:17:59 | 20260828-0831-B400_B.11-4 | 3910532 | P31_NoCPD_Day | w05220ss | - | + | - | - | - | + | + | Ref JA-SiS-III-91 Group Abbenseth_J JA-SiS-III-91 P-DNPA - 31P | sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0 |
| 4 | 09:15:35 | 20260828-0831-B400_B.11-4 | 3910531 | P31_Wide_Day | w05220ss | - | + | - | - | - | + | + | Ref JA-SiS-III-91 Group Abbenseth_J JA-SiS-III-91 P-DNPA - 31P{1H} | sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0 |
| 4 | 09:10:05 | 20260828-0831-B400_B.11-4 | 3910501 | H1_Day16 | w05220ss | + | + | - | + | + | + | + | Ref JA-SiS-III-91 Group Abbenseth_J JA-SiS-III-91 P-DNPA - 1H | |
| 55 | 09:05:19 | 20260828-0817-B400_B.11-54 | 20 | H1_Day16 | x06125gb | + | + | - | + | + | + | + | Ref GCGB512F2 Group Crisenza_G | |
| 54 | 08:59:57 | 20260828-0817-B400_B.11-54 | 10 | H1_Day16 | x06125gb | + | + | - | + | + | + | + | Ref GCGBMyrPR Group Crisenza_G | |
| 52 | 08:55:46 | 20260828-0655-B400_B.11-51 | 20 | H1_Day16 | d93111sd | + | + | - | + | + | + | + | Ref IL-SD2-33-r Group Larrosa_I | |
| 51 | 08:51:34 | 20260828-0655-B400_B.11-51 | 10 | H1_Day16 | d93111sd | + | + | - | + | + | + | + | Ref IL-SD2-32-r Group Larrosa_I | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 58 | 08:37:09 | 20260828-0825-B400_B.11-58 | 10 | H1_Night128 | mbdxkrn2 | + | + | - | + | + | + | + | Ref GDB-RN-DT002-1 5 days son, MeCN-washed crude material - Basic CDCl3 Group De bo_G | |
| 57 | 08:31:34 | 20260828-0824-B400_B.11-57 | 10 | H1_Night | mbdxkrn2 | + | + | - | + | + | + | + | Ref GDB-JZ002 After weeks in freezer - Basic CDCl3 Group De bo_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 56 | 08:27:06 | 20260828-0823-B400_B.11-56 | 10 | H1_Night | mbdxkrn2 | + | + | - | + | + | + | + | Ref GDB-RN Si Thing Repeat Prep'd - CD3CN Group De bo_G | |
| 49 | 07:51:49 | 20260827-2117-B400_B.11-47 | 20 | H1_WaterSupp_Night | f11141tm | + | + | - | + | + | + | + | Ref Cu(Salen)-Mn HCONH2 1.3V 30min Group Yang_S | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 48 | 07:16:19 | 20260827-2115-B400_B.11-48 | 10 | H1_WaterSupp_Night | f11141tm | + | + | - | + | + | + | + | Ref Cu(Salen)-Mn HCONH2 1.2V 30min Group Yang_S | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 47 | 06:40:25 | 20260827-2117-B400_B.11-47 | 10 | H1_WaterSupp_Night | f11141tm | + | + | - | + | + | + | + | Ref Cu(Salen)-Mn HCONH2 1.1V 30min Group Yang_S | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 51 | 06:05:16 | 20260827-1812-B400_B.11-51 | 14 | H1_C13_HMBC_Night | y52364mw | - | + | - | - | - | + | + | Ref GDB-MJ-D3-DMAP-heat-FULL Group De bo_G | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 51 | 05:49:55 | 20260827-1812-B400_B.11-51 | 13 | H1_C13_HSQC_Night | y52364mw | - | + | - | - | - | + | + | Ref GDB-MJ-D3-DMAP-heat-FULL Group De bo_G | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 51 | 04:56:10 | 20260827-1812-B400_B.11-51 | 12 | C13_CPD_Night1024 | y52364mw | - | + | - | - | - | + | + | Ref GDB-MJ-D3-DMAP-heat-FULL Group De bo_G | |
| 51 | 04:42:43 | 20260827-1812-B400_B.11-51 | 11 | H1_COSY_HiRes_Night | y52364mw | - | + | - | - | - | + | + | Ref GDB-MJ-D3-DMAP-heat-FULL Group De bo_G | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 51 | 04:38:34 | 20260827-1812-B400_B.11-51 | 10 | H1_Night | y52364mw | + | + | - | + | + | + | + | Ref GDB-MJ-D3-DMAP-heat-FULL Group De bo_G | |
| 52 | 04:03:26 | 20260827-1811-B400_B.11-52 | 13 | H1_C13_HMBC_Night | y52364mw | - | + | - | - | - | + | + | Ref GDB-MJ-361-FULL Group De bo_G | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 52 | 03:48:04 | 20260827-1811-B400_B.11-52 | 12 | H1_C13_HSQC_Night | y52364mw | - | + | - | - | - | + | + | Ref GDB-MJ-361-FULL Group De bo_G | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 52 | 02:54:19 | 20260827-1811-B400_B.11-52 | 11 | C13_CPD_Night1024 | y52364mw | - | + | - | - | - | + | + | Ref GDB-MJ-361-FULL Group De bo_G | |
| 52 | 02:49:32 | 20260827-1811-B400_B.11-52 | 10 | H1_Night | y52364mw | + | + | - | + | + | + | + | Ref GDB-MJ-361-FULL Group De bo_G | |
| 41 | 02:22:17 | 20260827-1749-B400_B.11-41 | 12 | C13_DEPT135_Night | m52750pm | - | + | - | - | - | + | + | Ref GCPM394cr-D Group Crisenza_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 41 | 02:08:02 | 20260827-1749-B400_B.11-41 | 11 | C13_CPD_Night256 | m52750pm | - | + | - | - | - | + | + | Ref GCPM394cr-C Group Crisenza_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 41 | 02:03:51 | 20260827-1749-B400_B.11-41 | 10 | H1_Night | m52750pm | + | + | - | + | + | + | + | Ref GCPM394cr-H Group Crisenza_G | |
| 39 | 01:58:09 | 20260827-1729-B400_B.11-39 | 10 | H1_Day | m19368jb | + | + | - | + | + | + | + | Ref AK-JB115C Group Keerthi_A | |
| 38 | 01:43:53 | 20260827-1659-B400_B.11-38 | 13 | C13_CPD_Night256 | m52750pm | - | + | - | - | - | + | + | Ref GCPM391Ccr-Hrep-C Group Crisenza_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 38 | 01:16:39 | 20260827-1659-B400_B.11-38 | 12 | C13_DEPT135_Night | m52750pm | - | + | - | - | - | + | + | Ref GCPM391Ccr-Hrep-D Group Crisenza_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 38 | 01:11:55 | 20260827-1659-B400_B.11-38 | 11 | H1_Night | m52750pm | + | + | - | + | + | + | + | Ref GCPM391Ccr-Hrep Group Crisenza_G | |
| 25 | 23:42:48 | 20260827-1600-B400_B.11-25 | 11 | H1_Night1024 | mbdxkrn2 | + | + | - | + | + | + | + | Ref GDB-RN-DT-002-1 5 days sonication, crude mixture aliquot - DMSO-d6 Group De bo_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 35 | 22:45:10 | 20260827-1144-B400_B.11-35 | 12 | C13_CPD_Night1024 | q20548kk | + | + | - | + | + | + | + | Ref ak-kk-hatf6-2 Group Keerthi_A | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 23 | 21:46:26 | 20260826-1813-B400_B.11-23 | 10 | C13_CPD_Night1024 | k02620dc | + | + | - | + | x | + | + | Ref DC-WM2-21-RP-CV-20 Group Leigh_D | topshim: TopshimPerformShimming - too many points lost during fit, Shim failed, sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 46 | 21:32:44 | 20260827-2114-B400_B.11-46 | 10 | H1_Night128 | f11141tm | + | + | - | + | + | + | + | Ref Cu(Salen)-Mn Ar-CH2Br coupling 8mA 1h Group Yang_S | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 45 | 21:17:48 | 20260827-2117-B400_B.11-45 | 10 | H1_Night128 | f11141tm | + | + | - | + | + | + | + | Ref Cu(Salen)-Mn Ar-CH2Br coupling 5mA 1h Group Yang_S | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 8 | 21:14:25 | 20260827-2039-B400_B.11-8 | 10 | H1_Day | z92209cg | + | + | - | + | + | + | + | Ref ALF202 fuelled 2h Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 13 | 21:09:04 | 20260827-2019-B400_B.11-13 | 10 | H1_Night | a58114lt | + | + | - | + | + | + | + | Ref b2p5-13-18 Group Leigh_D | |
| 12 | 21:03:21 | 20260827-2019-B400_B.11-12 | 10 | H1_Night | a58114lt | + | + | - | + | + | + | + | Ref b2p5-13-8 Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 11 | 20:59:07 | 20260827-2019-B400_B.11-11 | 10 | H1_Night | a58114lt | + | + | - | + | + | + | + | Ref b2p5-13-4 Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 7 | 20:53:45 | 20260827-2016-B400_B.11-7 | 10 | H1_Night | a58114lt | + | + | - | + | + | + | + | Ref b2p5-10-23 Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 6 | 20:48:25 | 20260827-2015-B400_B.11-6 | 10 | H1_Night | a58114lt | + | + | - | + | + | + | + | Ref b2p5-10-20 Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 5 | 20:43:20 | 20260827-2015-B400_B.11-5 | 10 | H1_Night | a58114lt | + | + | - | + | + | + | + | Ref b2p5-10-15 Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 4 | 20:37:54 | 20260827-2015-B400_B.11-4 | 10 | H1_Night | a58114lt | + | + | - | + | + | + | + | Ref b2p5-10-5 Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 3 | 20:23:24 | 20260827-1943-B400_B.11-2 | 20 | H1_Night128 | m09677nb | + | + | - | + | + | + | + | Ref 2ph 3me no2 Group Greaney_M | |
| 2 | 20:08:30 | 20260827-1943-B400_B.11-2 | 10 | H1_Night128 | m09677nb | + | + | - | + | + | + | + | Ref dime no2 Group Greaney_M | |
| 1 | 19:29:14 | 20260826-1705-B400_B.11-1 | 15 | H1_C13_HMBC_Night | y23702lt | + | + | - | + | + | + | + | Ref LT_AT_OHfull Group Warren_J | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 50 | 19:26:11 | 20260827-1904-B400_B.11-50 | 10 | H1_Day | z92209cg | + | + | - | + | + | + | + | Ref ALF202 fuelled 45 min Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 49 | 19:22:30 | 20260827-1857-B400_B.11-49 | 10 | H1_Day | z92209cg | + | + | - | + | + | + | + | Ref ALF197 2 fuelled 5d Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 48 | 19:19:30 | 20260827-1857-B400_B.11-48 | 10 | H1_Day | z92209cg | + | + | - | + | + | + | + | Ref ALF196 2 fuelled 5d Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 47 | 19:16:22 | 20260827-1856-B400_B.11-47 | 10 | H1_Day | z92209cg | + | + | - | + | + | + | + | Ref ALF195 2 fuelled 5d Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 46 | 19:12:43 | 20260827-1856-B400_B.11-46 | 10 | H1_Day | z92209cg | + | + | - | + | + | + | + | Ref ALF194 2 fuelled 5d Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 22 | 19:07:37 | 20260827-1853-B400_B.11-22 | 10 | H1_Day | j45108ph | + | + | - | + | + | + | + | Ref ph-780-30h Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 21 | 19:03:42 | 20260827-1849-B400_B.11-21 | 10 | H1_Day | j45108ph | + | + | - | + | + | + | + | Ref ph-742-3rd-red-dm Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 45 | 19:00:20 | 20260827-1845-B400_B.11-45 | 10 | H1_Day | z92209cg | + | + | - | + | + | + | + | Ref ALF202 fuelled 10 min Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 44 | 18:54:33 | 20260827-1826-B400_B.11-42 | 30 | H1_Day16 | x06125gb | + | + | - | + | + | + | + | Ref GCGB513F35-57 Group Crisenza_G | |
| 43 | 18:49:26 | 20260827-1826-B400_B.11-42 | 20 | H1_Day16 | x06125gb | + | + | - | + | + | + | + | Ref GCGB513F16-18 Group Crisenza_G | |
| 42 | 18:43:41 | 20260827-1826-B400_B.11-42 | 10 | H1_Day16 | x06125gb | + | + | - | + | + | + | + | Ref GCGB512F1 Group Crisenza_G | |
| 34 | 18:40:24 | 20260827-1822-B400_B.11-34 | 10 | H1_Day | z92209cg | + | + | - | + | + | + | + | Ref ALF202 prefuel Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 40 | 18:29:31 | 20260827-1735-B400_B.11-40 | 10 | H1_Quant_Night | z16689fe | + | + | - | + | + | + | + | Ref DJP TL 058 cr Group Procter_D | |
| 31 | 18:19:29 | 20260827-1638-B400_B.11-31 | 11 | H1_Quant_Night | c15276ec | + | + | - | + | + | + | + | Ref exc258-stepwise-hydrolysis-dimethoxymotor-2 Group Leigh_D exc258-stepwise-hydrolysis-dimethoxymotor-2 | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 34 | 18:05:14 | 20260827-1654-B400_B.11-34 | 12 | C13_CPD_Night256 | e72206ov | - | + | - | - | - | + | + | Ref iPr2O in MeCN Group De bo_G | |
| 34 | 18:00:34 | 20260827-1654-B400_B.11-34 | 11 | H1_Night | e72206ov | + | + | - | + | + | + | + | Ref iPr2O in MeCN Group De bo_G | |
| 36 | 17:43:42 | 20260827-1647-B400_B.11-36 | 12 | C13_CPD_Night256 | e02956op | + | + | - | + | + | + | + | Ref GDB-OP0570-13Cn_CDCl3 Group De bo_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 37 | 17:27:16 | 20260827-1647-B400_B.11-36 | 22 | C13_CPD_Night256 | e02956op | + | + | - | + | + | + | + | Ref GDB-OP0571-13Cn_CDCl3 Group De bo_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 39 | 17:22:29 | 20260827-1718-B400_B.11-39 | 2000000001 | H1_Day | w05220ss | + | + | - | + | + | + | + | Ref JA-SiRi-Murali2 Group Abbenseth_J SiRIMurali2 after 30 min 450 nm | |
| 38 | 17:19:21 | 20260827-1659-B400_B.11-38 | 10 | H1_Day | m52750pm | + | + | - | + | + | + | + | Ref GCPM391Ccr Group Crisenza_G | |
| 37 | 17:17:27 | 20260827-1647-B400_B.11-36 | 21 | C13_CPD_Day | e02956op | - | + | - | - | - | + | + | Ref GDB-OP0571-13Cd_CDCl3 Group De bo_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 37 | 17:13:04 | 20260827-1647-B400_B.11-36 | 20 | H1_Day16 | e02956op | + | + | - | + | + | + | + | Ref GDB-OP0571-1H_CDCl3 Group De bo_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 36 | 17:11:08 | 20260827-1647-B400_B.11-36 | 11 | C13_CPD_Day | e02956op | - | + | - | - | - | + | + | Ref GDB-OP0570-13Cd_CDCl3 Group De bo_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 36 | 17:06:29 | 20260827-1647-B400_B.11-36 | 10 | H1_Day16 | e02956op | + | + | - | + | + | + | + | Ref GDB-OP0570-1H_CDCl3 Group De bo_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 33 | 17:01:49 | 20260827-1216-B400_B.11-32 | 21 | H1_Day16 | d93111sd | + | + | - | + | + | + | + | Ref IL-SD2-23b Group Larrosa_I | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 32 | 16:55:50 | 20260827-1216-B400_B.11-32 | 11 | H1_Day16 | d93111sd | + | + | - | + | + | + | + | Ref IL-SD2-23-a Group Larrosa_I | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 31 | 16:51:36 | 20260827-1638-B400_B.11-31 | 10 | H1_Day | c15276ec | + | + | - | + | + | + | + | Ref exc258-stepwise-hydrolysis-dimethoxymotor Group Leigh_D exc258-stepwise-hydrolysis-dimethoxymotor | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 30 | 16:45:00 | 20260827-1610-B400_B.11-30 | 10 | H1_Day16 | h32367lm | + | + | - | + | + | + | + | Ref LM_FMac_Del_39 Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 29 | 16:40:17 | 20260827-1610-B400_B.11-29 | 10 | H1_Day16 | h32367lm | + | + | - | + | + | + | + | Ref LM_FMac_Del_31 Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 27 | 16:33:58 | 20260826-1954-B400_B.11-27 | 11 | H1_Day16 | z92209cg | + | + | - | + | + | + | + | Ref gcu-005-polyrot-2708 Group Leigh_D | |
| 26 | 16:29:39 | 20260827-1601-B400_B.11-26 | 10 | H1_Day16 | mbdxkrn2 | + | + | - | + | + | + | + | Ref GDB-RN BG-027b - DMSO-d6 Group De bo_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 25 | 16:15:33 | 20260827-1600-B400_B.11-25 | 10 | H1_Day16 | mbdxkrn2 | + | + | - | + | + | + | + | Ref GDB-RN-DT-002-1 5 days sonication, crude mixture aliquot - DMSO-d6 Group De bo_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 24 | 16:11:10 | 20260827-1548-B400_B.11-24 | 10 | H1_Day | c15276ec | + | + | - | + | + | + | + | Ref exc258-stepwise-fuelled-2-dimethoxymotor Group Leigh_D exc258-stepwise-fuelled-2-dimethoxymotor | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 22 | 16:05:47 | 20260827-1546-B400_B.11-22 | 10 | H1_Day | z92209cg | + | + | - | + | + | + | + | Ref DJT 09.101.02 Group Leigh_D | |
| 21 | 16:02:37 | 20260827-1542-B400_B.11-21 | 10 | H1_Day | m19368jb | + | + | - | + | + | + | + | Ref AK-JB118C Group Keerthi_A | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 20 | 15:58:13 | 20260827-1541-B400_B.11-20 | 10 | H1_Day16 | d08103sl | + | + | - | + | + | + | + | Ref sl-8 cdcl3 Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 19 | 15:54:53 | 20260827-1539-B400_B.11-19 | 10 | H1_Day | z92209cg | + | + | - | + | + | + | + | Ref AL PH 678 no cage 7:3 Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 18 | 15:51:27 | 20260827-1524-B400_B.11-18 | 10 | H1_Day | z92209cg | + | + | - | + | + | + | + | Ref AL PH 678 dep t-bu mot sample Group Leigh_D LPt added | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 17 | 15:48:01 | 20260827-1523-B400_B.11-17 | 10 | H1_Day | z92209cg | + | + | - | + | + | + | + | Ref PH681-sample buffered Group Leigh_D | |
| 16 | 15:42:39 | 20260824-1446-B400_B.11-16 | 11 | H1_Day16 | q62112nk | + | + | - | + | + | + | + | Ref djp-nk-474A Group Procter_D | |
| 15 | 15:40:44 | 20260827-1518-B400_B.11-15 | 11 | C13_CPD_Day | h32367lm | - | + | - | - | - | + | + | Ref LM_FMacDel2808_F30 Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 15 | 15:36:04 | 20260827-1518-B400_B.11-15 | 10 | H1_Day16 | h32367lm | + | + | - | + | + | + | + | Ref LM_FMacDel2808_F30 Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 14 | 15:16:36 | 20260827-1100-B400_B.11-14 | 11 | H1_C13_HSQC_Night | f11141tm | + | + | - | + | + | + | + | Ref Cu(Salen)-Sm Chan-lam 0.9V HSQC Group Yang_S | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 56 | 15:11:08 | 20260827-1507-B400_B.11-56 | 10 | H1_Day16 | x06125gb | + | + | - | + | + | + | + | Ref GCGB513F35-42 Group Crisenza_G | |
| 55 | 15:07:08 | 20260827-1459-B400_B.11-55 | 10 | H1_Day | k02620dc | + | + | - | + | + | + | + | Ref DJT09-101-01 Group Leigh_D | |
| 54 | 15:02:50 | 20260827-1438-B400_B.11-54 | 10 | H1_Day | c15276ec | + | + | - | + | + | + | + | Ref exc258-stepwise-fuel-methoxymotor Group Leigh_D exc258-stepwise-fuel-methoxymotor | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 53 | 15:02:22 | 20260827-1437-B400_B.11-53 | 10 | H1_Day | j82494jb | - | - | - | - | - | - | - | Ref QBB-G144-1hr Group Leigh_D | |
| 52 | 14:55:46 | 20260827-1337-B400_B.11-52 | 11 | H1_Day16 | q17816aj | + | + | - | + | + | + | + | Ref IR-AJ_tpa_check_ppt Group Riddell_I | |
| 51 | 14:51:39 | 20260827-1330-B400_B.11-51 | 10 | H1_Day | z92209cg | + | + | - | + | + | + | + | Ref AL PH678 dep new sample Group Leigh_D LPt complex not added | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 50 | 14:45:41 | 20260827-1302-B400_B.11-50 | 10 | H1_Day16 | x06125gb | + | + | - | + | + | + | + | Ref GCGB513Flush Group Crisenza_G | |
| 49 | 14:41:30 | 20260827-1322-B400_B.11-49 | 10 | H1_Day16 | p13528bg | + | + | - | + | + | + | + | Ref BG-040b) extra H2O wash Group De bo_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 48 | 14:36:55 | 20260827-1322-B400_B.11-48 | 10 | H1_Day16 | p13528bg | + | + | - | + | + | + | + | Ref BG-062a) post precip Group De bo_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 47 | 14:32:13 | 20260827-1311-B400_B.11-47 | 10 | H1_Day16 | d08103sl | + | + | - | + | + | + | + | Ref sl-17 Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 46 | 14:26:47 | 20260827-1301-B400_B.11-44 | 30 | H1_Day16 | x06125gb | + | + | - | + | + | + | + | Ref GCGB513F58-70 Group Crisenza_G | |
| 45 | 14:21:21 | 20260827-1301-B400_B.11-44 | 20 | H1_Day16 | x06125gb | + | + | - | + | + | + | + | Ref GCGB513F44-51 Group Crisenza_G | |
| 44 | 14:15:41 | 20260827-1301-B400_B.11-44 | 10 | H1_Day16 | x06125gb | + | + | - | + | + | + | + | Ref GCGB513F19-27 Group Crisenza_G | |
| 43 | 14:11:08 | 20260827-1233-B400_B.11-43 | 10 | C13_CPD_Day | e72206ov | + | + | - | + | + | + | + | Ref ov-019.7-b, iPr2O layer Group De bo_G | pp: Unable to assign a peak for scaling of /mnt/nmrdata/De/data/e72206ov/nmr/20260827-1233-B400_B.11-43/10/pdata/1/peaks No peak is found in the specified ranges!, pp: Unable to assign a peak for scaling of /mnt/nmrdata/De/data/e72206ov/nmr/20260827-1233-B400_B.11-43/10/pdata/1/peaks No peak is found in the specified ranges! |
| 42 | 14:09:06 | 20260827-1145-B400_B.11-41 | 21 | F19_NoCPD_Day | j40457bh | - | + | - | - | - | + | + | Ref bh no cycloadduct std Group Trowbridge_A | log_err: acqt0 not set in pulse program, result may be incorrect!, log_err: acqt0 not set in pulse program, result may be incorrect!, sref: NUCLEUS '19F' not defined for SOLVENT 'MeOD' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'MeOD' SR is set to 0.0 |
| 42 | 14:05:20 | 20260827-1145-B400_B.11-41 | 20 | H1_Day | j40457bh | + | + | - | + | + | + | + | Ref bh no cycloadduct std Group Trowbridge_A | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 41 | 14:03:19 | 20260827-1147-B400_B.11-41 | 11 | F19_NoCPD_Day | j40457bh | - | + | - | - | - | + | + | Ref bhnourea std Group Trowbridge_A | log_err: acqt0 not set in pulse program, result may be incorrect!, log_err: acqt0 not set in pulse program, result may be incorrect!, sref: NUCLEUS '19F' not defined for SOLVENT 'MeOD' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'MeOD' SR is set to 0.0 |
| 41 | 13:58:13 | 20260827-1147-B400_B.11-41 | 10 | H1_Day | j40457bh | + | + | - | + | + | + | + | Ref bhnourea std Group Trowbridge_A | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 40 | 13:53:23 | 20260827-1232-B400_B.11-40 | 10 | H1_Day | e72206ov | + | + | - | + | + | + | + | Ref 3-hydroxy-5-methoxytoluene Group De bo_G | |
| 39 | 13:51:20 | 20260827-1134-B400_B.11-39 | 13 | F19_NoCPD_Day | q50682hk | - | + | - | - | - | + | + | Ref HK-DW pFBE Group Willcox_D | log_err: acqt0 not set in pulse program, result may be incorrect!, log_err: acqt0 not set in pulse program, result may be incorrect!, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0 |
| 39 | 13:48:53 | 20260827-1134-B400_B.11-39 | 12 | B11_CPD_Day | q50682hk | - | + | - | - | - | + | + | Ref HK-DW pFBE Group Willcox_D | sref: NUCLEUS '11B' not defined for SOLVENT 'CDCl3' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Willcox_D/data/q50682hk/nmr/20260827-1134-B400_B.11-39/12/pdata/1/peaks!, sref: NUCLEUS '11B' not defined for SOLVENT 'CDCl3' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Willcox_D/data/q50682hk/nmr/20260827-1134-B400_B.11-39/12/pdata/1/peaks! |
| 39 | 13:46:30 | 20260827-1134-B400_B.11-39 | 11 | C13_CPD_Day | q50682hk | - | + | - | - | - | + | + | Ref HK-DW pFBE Group Willcox_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 39 | 13:41:55 | 20260827-1134-B400_B.11-39 | 10 | H1_Day | q50682hk | + | + | - | + | + | + | + | Ref HK-DW pFBE Group Willcox_D | |
| 38 | 13:40:04 | 20260827-1133-B400_B.11-38 | 14 | F19_NoCPD_Day | q50682hk | - | + | - | - | - | + | + | Ref HK-DW-162 pF Group Willcox_D | log_err: acqt0 not set in pulse program, result may be incorrect!, log_err: acqt0 not set in pulse program, result may be incorrect!, sref: NUCLEUS '19F' not defined for SOLVENT 'C6D6' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'C6D6' SR is set to 0.0 |
| 38 | 13:36:59 | 20260827-1133-B400_B.11-38 | 13 | P31_Wide_Day | q50682hk | - | + | - | - | - | + | + | Ref HK-DW-162 pF Group Willcox_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 38 | 13:34:52 | 20260827-1133-B400_B.11-38 | 12 | B11_NoCPD_Day | q50682hk | - | + | - | - | - | + | + | Ref HK-DW-162 pF Group Willcox_D | log_err: acqt0 not set in pulse program, result may be incorrect!, log_err: acqt0 not set in pulse program, result may be incorrect!, sref: NUCLEUS '11B' not defined for SOLVENT 'C6D6' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Willcox_D/data/q50682hk/nmr/20260827-1133-B400_B.11-38/12/pdata/1/peaks!, sref: NUCLEUS '11B' not defined for SOLVENT 'C6D6' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Willcox_D/data/q50682hk/nmr/20260827-1133-B400_B.11-38/12/pdata/1/peaks! |
| 38 | 13:32:19 | 20260827-1133-B400_B.11-38 | 11 | C13_CPD_Day | q50682hk | - | + | - | - | - | + | + | Ref HK-DW-162 pF Group Willcox_D | sref: reference peak not found default calibration done; pp: Unable to assign a peak for scaling of /mnt/nmrdata/Willcox_D/data/q50682hk/nmr/20260827-1133-B400_B.11-38/11/pdata/1/peaks No peak is found in the specified ranges!, sref: reference peak not found default calibration done; pp: Unable to assign a peak for scaling of /mnt/nmrdata/Willcox_D/data/q50682hk/nmr/20260827-1133-B400_B.11-38/11/pdata/1/peaks No peak is found in the specified ranges! |
| 38 | 13:28:21 | 20260827-1133-B400_B.11-38 | 10 | H1_Day | q50682hk | + | + | - | + | + | + | + | Ref HK-DW-162 pF Group Willcox_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 37 | 13:26:16 | 20260827-1144-B400_B.11-35 | 31 | F19_NoCPD_Day | j40457bh | - | + | - | - | - | + | + | Ref bhno hydroxamic acid std Group Trowbridge_A | log_err: acqt0 not set in pulse program, result may be incorrect!, log_err: acqt0 not set in pulse program, result may be incorrect!, sref: NUCLEUS '19F' not defined for SOLVENT 'MeOD' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'MeOD' SR is set to 0.0 |
| 37 | 13:21:40 | 20260827-1144-B400_B.11-35 | 30 | H1_Day | j40457bh | + | + | - | + | + | + | + | Ref bhno hydroxamic acid std Group Trowbridge_A | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 36 | 13:19:38 | 20260827-1144-B400_B.11-35 | 21 | F19_NoCPD_Day | j40457bh | - | + | - | - | - | + | + | Ref bhno aniline std Group Trowbridge_A | log_err: acqt0 not set in pulse program, result may be incorrect!, log_err: acqt0 not set in pulse program, result may be incorrect!, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0 |
| 36 | 13:15:02 | 20260827-1144-B400_B.11-35 | 20 | H1_Day | j40457bh | + | + | - | + | + | + | + | Ref bhno aniline std Group Trowbridge_A | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 35 | 13:13:00 | 20260827-1144-B400_B.11-35 | 11 | F19_NoCPD_Day | j40457bh | - | + | - | - | - | + | + | Ref bhno sm std Group Trowbridge_A | log_err: acqt0 not set in pulse program, result may be incorrect!, log_err: acqt0 not set in pulse program, result may be incorrect!, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0 |
| 35 | 13:08:38 | 20260827-1144-B400_B.11-35 | 10 | H1_Day | j40457bh | + | + | - | + | + | + | + | Ref bhno sm std Group Trowbridge_A | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 34 | 13:05:19 | 20260827-1129-B400_B.11-34 | 14 | P31_Wide_Day | q50682hk | - | + | - | - | - | + | + | Ref HK-DW-158 fexyl Group Willcox_D | sref: reference peak not found default calibration done; pp: Cannot find any peak for scaling in /mnt/nmrdata/Willcox_D/data/q50682hk/nmr/20260827-1129-B400_B.11-34/14/pdata/1/peaks!, sref: reference peak not found default calibration done; pp: Cannot find any peak for scaling in /mnt/nmrdata/Willcox_D/data/q50682hk/nmr/20260827-1129-B400_B.11-34/14/pdata/1/peaks! |
| 34 | 13:03:26 | 20260827-1129-B400_B.11-34 | 13 | F19_NoCPD_Day | q50682hk | - | + | - | - | - | + | + | Ref HK-DW-158 fexyl Group Willcox_D | log_err: acqt0 not set in pulse program, result may be incorrect!, log_err: acqt0 not set in pulse program, result may be incorrect!, sref: NUCLEUS '19F' not defined for SOLVENT 'C6D6' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'C6D6' SR is set to 0.0 |
| 34 | 13:01:10 | 20260827-1129-B400_B.11-34 | 12 | B11_NoCPD_Day | q50682hk | - | + | - | - | - | + | + | Ref HK-DW-158 fexyl Group Willcox_D | log_err: acqt0 not set in pulse program, result may be incorrect!, log_err: acqt0 not set in pulse program, result may be incorrect!, sref: NUCLEUS '11B' not defined for SOLVENT 'C6D6' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Willcox_D/data/q50682hk/nmr/20260827-1129-B400_B.11-34/12/pdata/1/peaks!, sref: NUCLEUS '11B' not defined for SOLVENT 'C6D6' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Willcox_D/data/q50682hk/nmr/20260827-1129-B400_B.11-34/12/pdata/1/peaks! |
| 34 | 12:58:48 | 20260827-1129-B400_B.11-34 | 11 | C13_CPD_Day | q50682hk | - | + | - | - | - | + | + | Ref HK-DW-158 fexyl Group Willcox_D | sref: reference peak not found default calibration done; pp: Unable to assign a peak for scaling of /mnt/nmrdata/Willcox_D/data/q50682hk/nmr/20260827-1129-B400_B.11-34/11/pdata/1/peaks No peak is found in the specified ranges!, sref: reference peak not found default calibration done; pp: Unable to assign a peak for scaling of /mnt/nmrdata/Willcox_D/data/q50682hk/nmr/20260827-1129-B400_B.11-34/11/pdata/1/peaks No peak is found in the specified ranges! |
| 34 | 12:55:15 | 20260827-1129-B400_B.11-34 | 10 | H1_Day | q50682hk | + | + | - | + | + | + | + | Ref HK-DW-158 fexyl Group Willcox_D | |
| 33 | 12:54:51 | 20260827-1216-B400_B.11-32 | 20 | H1_Day16 | d08103sl | x | - | - | - | - | - | - | Ref sl-17 Group Leigh_D | WebService Error: 103.310.145:Sample Missing Error:No sample found with Position or Tube ID '1.33'. |
| 32 | 12:54:23 | 20260827-1216-B400_B.11-32 | 10 | H1_Day16 | d08103sl | - | - | - | - | - | - | - | Ref sl-8 Group Leigh_D | |
| 31 | 12:52:20 | 20260827-1131-B400_B.11-31 | 14 | F19_NoCPD_Day | q50682hk | - | + | - | - | - | + | + | Ref HK-DW-100 ??? Group Willcox_D | log_err: acqt0 not set in pulse program, result may be incorrect!, log_err: acqt0 not set in pulse program, result may be incorrect!, sref: reference peak outside file limits default calibration done; pp: Cannot find any peak for scaling in /mnt/nmrdata/Willcox_D/data/q50682hk/nmr/20260827-1131-B400_B.11-31/14/pdata/1/peaks!, sref: reference peak outside file limits default calibration done; pp: Cannot find any peak for scaling in /mnt/nmrdata/Willcox_D/data/q50682hk/nmr/20260827-1131-B400_B.11-31/14/pdata/1/peaks! |
| 31 | 12:49:24 | 20260827-1131-B400_B.11-31 | 13 | P31_CPD_Day | q50682hk | - | + | - | - | - | + | + | Ref HK-DW-100 ??? Group Willcox_D | sref: NUCLEUS '31P' not defined for SOLVENT 'THF' SR is set to 0.0; pp: Cannot find any peak for scaling in /mnt/nmrdata/Willcox_D/data/q50682hk/nmr/20260827-1131-B400_B.11-31/13/pdata/1/peaks!, sref: NUCLEUS '31P' not defined for SOLVENT 'THF' SR is set to 0.0; pp: Cannot find any peak for scaling in /mnt/nmrdata/Willcox_D/data/q50682hk/nmr/20260827-1131-B400_B.11-31/13/pdata/1/peaks! |
| 31 | 12:46:56 | 20260827-1131-B400_B.11-31 | 12 | B11_CPD_Day | q50682hk | - | + | - | - | - | + | + | Ref HK-DW-100 ??? Group Willcox_D | sref: NUCLEUS '11B' not defined for SOLVENT 'THF' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Willcox_D/data/q50682hk/nmr/20260827-1131-B400_B.11-31/12/pdata/1/peaks!, sref: NUCLEUS '11B' not defined for SOLVENT 'THF' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Willcox_D/data/q50682hk/nmr/20260827-1131-B400_B.11-31/12/pdata/1/peaks! |
| 31 | 12:44:31 | 20260827-1131-B400_B.11-31 | 11 | C13_CPD_Day | q50682hk | - | + | - | - | - | + | + | Ref HK-DW-100 ??? Group Willcox_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 31 | 12:39:43 | 20260827-1131-B400_B.11-31 | 10 | H1_Day | q50682hk | + | + | - | + | + | + | + | Ref HK-DW-100 ??? Group Willcox_D | |
| 30 | 12:36:31 | 20260827-1129-B400_B.11-30 | 14 | P31_Wide_Day | q50682hk | - | + | - | - | - | + | + | Ref HK-DW-161 2.0 Group Willcox_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 30 | 12:34:38 | 20260827-1129-B400_B.11-30 | 13 | F19_NoCPD_Day | q50682hk | - | + | - | - | - | + | + | Ref HK-DW-161 2.0 Group Willcox_D | log_err: acqt0 not set in pulse program, result may be incorrect!, log_err: acqt0 not set in pulse program, result may be incorrect!, sref: NUCLEUS '19F' not defined for SOLVENT 'C6D6' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'C6D6' SR is set to 0.0 |
| 30 | 12:32:31 | 20260827-1129-B400_B.11-30 | 12 | B11_NoCPD_Day | q50682hk | - | + | - | - | - | + | + | Ref HK-DW-161 2.0 Group Willcox_D | log_err: acqt0 not set in pulse program, result may be incorrect!, log_err: acqt0 not set in pulse program, result may be incorrect!, sref: NUCLEUS '11B' not defined for SOLVENT 'C6D6' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Willcox_D/data/q50682hk/nmr/20260827-1129-B400_B.11-30/12/pdata/1/peaks!, sref: NUCLEUS '11B' not defined for SOLVENT 'C6D6' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Willcox_D/data/q50682hk/nmr/20260827-1129-B400_B.11-30/12/pdata/1/peaks! |
| 30 | 12:30:07 | 20260827-1129-B400_B.11-30 | 11 | C13_CPD_Day | q50682hk | - | + | - | - | - | + | + | Ref HK-DW-161 2.0 Group Willcox_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 30 | 12:26:42 | 20260827-1129-B400_B.11-30 | 10 | H1_Day | q50682hk | + | + | - | + | + | + | + | Ref HK-DW-161 2.0 Group Willcox_D | |
| 29 | 12:24:46 | 20260827-1128-B400_B.11-29 | 14 | F19_NoCPD_Day | q50682hk | - | + | - | - | - | + | + | Ref HK-DW-161 1.0 Group Willcox_D | log_err: acqt0 not set in pulse program, result may be incorrect!, log_err: acqt0 not set in pulse program, result may be incorrect!, sref: NUCLEUS '19F' not defined for SOLVENT 'C6D6' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'C6D6' SR is set to 0.0 |
| 29 | 12:21:51 | 20260827-1128-B400_B.11-29 | 13 | P31_Wide_Day | q50682hk | - | + | - | - | - | + | + | Ref HK-DW-161 1.0 Group Willcox_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 29 | 12:19:45 | 20260827-1128-B400_B.11-29 | 12 | B11_NoCPD_Day | q50682hk | - | + | - | - | - | + | + | Ref HK-DW-161 1.0 Group Willcox_D | log_err: acqt0 not set in pulse program, result may be incorrect!, log_err: acqt0 not set in pulse program, result may be incorrect!, sref: NUCLEUS '11B' not defined for SOLVENT 'C6D6' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Willcox_D/data/q50682hk/nmr/20260827-1128-B400_B.11-29/12/pdata/1/peaks!, sref: NUCLEUS '11B' not defined for SOLVENT 'C6D6' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Willcox_D/data/q50682hk/nmr/20260827-1128-B400_B.11-29/12/pdata/1/peaks! |
| 29 | 12:17:24 | 20260827-1128-B400_B.11-29 | 11 | C13_CPD_Day | q50682hk | - | + | - | - | - | + | + | Ref HK-DW-161 1.0 Group Willcox_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 29 | 12:13:51 | 20260827-1128-B400_B.11-29 | 10 | H1_Day | q50682hk | + | + | - | + | + | + | + | Ref HK-DW-161 1.0 Group Willcox_D | |
| 26 | 12:10:05 | 20260827-1120-B400_B.11-26 | 10 | H1_Day | c15276ec | + | + | - | + | + | + | + | Ref exc253-background-kcl-bulkyfuel Group Leigh_D exc253-background-kcl-bulkyfuel | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 25 | 12:06:22 | 20260827-1120-B400_B.11-25 | 10 | H1_Day | c15276ec | + | + | - | + | + | + | + | Ref exc253-background-nacl-bulkyfuel Group Leigh_D exc253-background-nacl-bulkyfuel | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 24 | 12:01:46 | 20260827-1120-B400_B.11-24 | 10 | H1_Day | c15276ec | + | + | - | + | + | + | + | Ref exc253-background-nosalt-bulkyfuel Group Leigh_D exc253-background-nosalt-bulkyfuel | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 22 | 11:59:46 | 20260827-1125-B400_B.11-22 | 13 | P31_NoCPD_Day | q50682hk | - | + | - | - | - | + | + | Ref HK-DW-157 Group Willcox_D | sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0 |
| 22 | 11:57:19 | 20260827-1125-B400_B.11-22 | 12 | P31_CPD_Day | q50682hk | - | + | - | - | - | + | + | Ref HK-DW-157 Group Willcox_D | sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0 |
| 22 | 11:54:43 | 20260827-1125-B400_B.11-22 | 11 | C13_CPD_Day | q50682hk | - | + | - | - | - | + | + | Ref HK-DW-157 Group Willcox_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 22 | 11:51:35 | 20260827-1125-B400_B.11-22 | 10 | H1_Day | q50682hk | + | + | - | + | + | + | + | Ref HK-DW-157 Group Willcox_D | |
| 21 | 11:49:51 | 20260827-1123-B400_B.11-21 | 11 | P31_CPD_Day | q50682hk | - | + | - | - | - | + | + | Ref sa-product-crude-thpp Group Willcox_D | sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0 |
| 21 | 11:45:04 | 20260827-1123-B400_B.11-21 | 10 | H1_Day | q50682hk | + | + | - | + | + | + | + | Ref sa-product-crude-thpp Group Willcox_D | |
| 20 | 11:42:39 | 20260827-1123-B400_B.11-20 | 11 | P31_CPD_Day | q50682hk | - | + | - | - | - | + | + | Ref sa-thpp Group Willcox_D | sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0 |
| 20 | 11:36:46 | 20260827-1123-B400_B.11-20 | 10 | H1_Day | q50682hk | + | + | - | + | + | + | + | Ref sa-thpp Group Willcox_D | |
| 19 | 11:32:56 | 20260827-1117-B400_B.11-19 | 10 | H1_Day | c15276ec | + | + | - | + | + | + | + | Ref exc253-bulky-kcl-30-12 Group Leigh_D exc253-bulky-kcl-30-12 | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 18 | 11:29:18 | 20260827-1117-B400_B.11-18 | 10 | H1_Day | c15276ec | + | + | - | + | + | + | + | Ref exc253-bulky-nacl-30-12 Group Leigh_D exc253-bulky-nacl-30-12 | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 17 | 11:24:35 | 20260827-1117-B400_B.11-17 | 10 | H1_Day | c15276ec | + | + | - | + | + | + | + | Ref exc253-bulky-nosalt-30-12 Group Leigh_D exc253-bulky-nosalt-30-12 | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 15 | 11:18:48 | 20260827-1105-B400_B.11-15 | 10 | H1_Day16 | h32367lm | + | + | - | + | + | + | + | Ref LM_FCat_Del_4-7_mCPBA Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 14 | 11:03:04 | 20260827-1100-B400_B.11-14 | 10 | H1_Night128 | f11141tm | + | + | - | + | + | + | + | Ref Cu(Salen)-Sm Chan-lam 0.9V 1h with lutidine Group Yang_S | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 32 | 10:59:15 | 20260827-1057-B400_B.11-32 | 10 | H1_Day | a91398js | + | + | - | + | + | + | + | Ref JaS_FeM_49_2_F3 Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 31 | 10:44:09 | 20260827-1043-B400_B.11-31 | 10 | H1_Day | m69722at | + | + | - | + | + | + | + | Ref AT-01-94-cr Group Leigh_D | |
| 17 | 10:31:19 | 20260827-1015-B400_B.11-17 | 10 | H1_Day | z92209cg | + | + | - | + | + | + | + | Ref AL142 2 end prod dry Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 15 | 10:23:58 | 20260827-1011-B400_B.11-15 | 10 | H1_Day | z92209cg | + | + | - | + | + | + | + | Ref ALF200 fuelled 2d after cage added Group Leigh_D | |
| 14 | 10:20:43 | 20260827-1011-B400_B.11-14 | 10 | H1_Day | z92209cg | + | + | - | + | + | + | + | Ref ALF201 fuelled 1d Group Leigh_D | |
| 13 | 10:15:36 | 20260827-1008-B400_B.11-13 | 10 | H1_Day | m19368jb | + | + | - | + | + | + | + | Ref AK-JB114-28 Group Keerthi_A | |
| 12 | 10:10:10 | 20260827-1008-B400_B.11-12 | 10 | H1_Day | m19368jb | + | + | - | + | + | + | + | Ref K-JB114-25 Group Keerthi_A | |
| 7 | 09:46:53 | 20260827-0945-B400_B.11-7 | 10 | H1_Day16 | p13528bg | + | + | - | + | + | + | + | Ref BG-059 Et2O Fully dried Group De bo_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 1 | 09:09:34 | 20260826-1705-B400_B.11-1 | 14 | H1_C13_HSQC_Night | y23702lt | + | + | - | + | + | + | + | Ref LT_AT_OHfull Group Warren_J | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 21 | 08:56:44 | 20260826-1802-B400_B.11-21 | 10 | H1_Quant_D1_25s_Day | z16689fe | + | + | - | + | + | + | + | Ref DJP FE 562 (crude) Group Procter_D | |
| 6 | 08:52:20 | 20260826-1707-B400_B.11-6 | 10 | H1_Day16 | p13528bg | + | + | - | + | + | + | + | Ref BG-061 prep b2 Group De bo_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 5 | 08:47:38 | 20260826-1707-B400_B.11-5 | 10 | H1_Day16 | p13528bg | + | + | - | + | + | + | + | Ref BG-061 prep b1 Group De bo_G | |
| 1 | 08:30:25 | 20260826-1705-B400_B.11-1 | 13 | H1_COSY_HiRes_Night | y23702lt | + | + | - | + | + | + | + | Ref LT_AT_OHfull Group Warren_J | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 2 | 08:25:35 | 20260827-0824-B400_B.11-2 | 10 | H1_Night | mbdxkrn2 | + | + | - | + | + | + | + | Ref GDB-RN Si Thing Recovered Prep Band - Acetone-d6 Group De bo_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 1 | 08:11:19 | 20260826-1705-B400_B.11-1 | 12 | C13_CPD_Night256 | y23702lt | - | + | - | - | - | + | + | Ref LT_AT_OHfull Group Warren_J | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 1 | 08:05:19 | 20260826-1705-B400_B.11-1 | 11 | H1_Night | y23702lt | + | + | - | + | + | + | + | Ref LT_AT_OHfull Group Warren_J | |
| 11 | 07:51:52 | 20260826-1654-B400_B.11-11 | 14 | H1_COSY_HiRes_Night | mbdxkrn2 | - | + | - | - | - | + | + | Ref GDB-RN1726 Full Char - CD3CN Group De bo_G | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 11 | 07:36:31 | 20260826-1654-B400_B.11-11 | 13 | H1_C13_HSQC_Night | mbdxkrn2 | - | + | - | - | - | + | + | Ref GDB-RN1726 Full Char - CD3CN Group De bo_G | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 11 | 07:01:22 | 20260826-1654-B400_B.11-11 | 12 | H1_C13_HMBC_Night | mbdxkrn2 | - | + | - | - | - | + | + | Ref GDB-RN1726 Full Char - CD3CN Group De bo_G | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 11 | 06:59:09 | 20260826-1654-B400_B.11-11 | 11 | H1_Night | mbdxkrn2 | - | + | - | - | - | + | + | Ref GDB-RN1726 Full Char - CD3CN Group De bo_G | |
| 11 | 05:10:44 | 20260826-1654-B400_B.11-11 | 10 | C13_CPD_Night1024 | mbdxkrn2 | + | + | - | + | + | + | + | Ref GDB-RN1726 Full Char - CD3CN Group De bo_G | |
| 10 | 05:07:50 | 20260826-1641-B400_B.11-8 | 30 | H1_Day | w61916tz | + | + | - | + | + | + | + | Ref sy-tz-25-1h-0h Group Yang_S | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 9 | 05:04:48 | 20260826-1641-B400_B.11-8 | 20 | H1_Day | w61916tz | + | + | - | + | + | + | + | Ref sy-tz-21-1h-0h Group Yang_S | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 8 | 05:01:43 | 20260826-1641-B400_B.11-8 | 10 | H1_Day | w61916tz | + | + | - | + | + | + | + | Ref sy-tz-20-1h-0h Group Yang_S | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 4 | 04:58:39 | 20260826-1641-B400_B.11-2 | 30 | H1_Day | w61916tz | + | + | - | + | + | + | + | Ref sy-tz-18-1h-0h Group Yang_S | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 3 | 04:55:10 | 20260826-1641-B400_B.11-2 | 20 | H1_Day | w61916tz | + | + | - | + | + | + | + | Ref sy-tz-14-1h-0h Group Yang_S | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 60 | 03:57:40 | 20260826-1637-B400_B.11-60 | 11 | C13_CPD_Night1024 | v73981ac | + | + | - | + | + | + | + | Ref IL-AC-ANG-13-pure Group Larrosa_I | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 46 | 03:42:27 | 20260826-1614-B400_B.11-46 | 14 | H1_C13_HSQC_US_Night | v73981ac | - | + | - | - | - | + | + | Ref IL-AC-ANG-12-pure Group Larrosa_I | |
| 46 | 03:40:14 | 20260826-1614-B400_B.11-46 | 13 | H1_Night | v73981ac | - | + | - | - | - | + | + | Ref IL-AC-ANG-12-pure Group Larrosa_I | |
| 46 | 02:45:44 | 20260826-1614-B400_B.11-46 | 12 | C13_CPD_Night1024 | v73981ac | - | + | - | - | - | + | + | Ref IL-AC-ANG-12-pure Group Larrosa_I | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 46 | 02:36:49 | 20260826-1614-B400_B.11-46 | 11 | F19_NoCPD_Night | v73981ac | + | + | - | + | + | + | + | Ref IL-AC-ANG-12-pure Group Larrosa_I | log_err: acqt0 not set in pulse program, result may be incorrect!, log_err: acqt0 not set in pulse program, result may be incorrect!, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0 |
| 59 | 02:34:49 | 20260826-1610-B400_B.11-59 | 4040232 | P31_NoCPD_Day | w05220ss | - | + | - | - | - | + | + | Ref JA-SiS-IV-04 Group Abbenseth_J JA-SiS-IV-04 PDNPA - 31P | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 59 | 02:32:15 | 20260826-1610-B400_B.11-59 | 4040231 | P31_Wide_Day | w05220ss | - | + | - | - | - | + | + | Ref JA-SiS-IV-04 Group Abbenseth_J JA-SiS-IV-04 PDNPA - 31P{1H} | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 59 | 01:57:06 | 20260826-1610-B400_B.11-59 | 4040205 | H1_C13_HMBC_Night | w05220ss | - | + | - | - | - | + | + | Ref JA-SiS-IV-04 Group Abbenseth_J JA-SiS-IV-04 PDNPA - HMBC | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 59 | 01:41:45 | 20260826-1610-B400_B.11-59 | 4040204 | H1_C13_HSQC_Night | w05220ss | - | + | - | - | - | + | + | Ref JA-SiS-IV-04 Group Abbenseth_J JA-SiS-IV-04 PDNPA - HSQC | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 59 | 01:28:12 | 20260826-1610-B400_B.11-59 | 4040203 | H1_COSY_HiRes_Night | w05220ss | - | + | - | - | - | + | + | Ref JA-SiS-IV-04 Group Abbenseth_J JA-SiS-IV-04 PDNPA - COSY | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 59 | 01:13:02 | 20260826-1610-B400_B.11-59 | 4040202 | C13_CPD_Night256 | w05220ss | - | + | - | - | - | + | + | Ref JA-SiS-IV-04 Group Abbenseth_J JA-SiS-IV-04 PDNPA - 13C | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 59 | 01:08:17 | 20260826-1610-B400_B.11-59 | 4040201 | H1_Night | w05220ss | + | + | - | + | + | + | + | Ref JA-SiS-IV-04 Group Abbenseth_J JA-SiS-IV-04 PDNPA - 1H | |
| 30 | 00:51:10 | 20260826-1447-B400_B.11-30 | 15 | H1_P31_HMBC_Night | e02956op | - | + | - | - | - | + | + | Ref GDB-OP0555-13C_MeCNd3 Group De bo_G | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 30 | 00:35:48 | 20260826-1447-B400_B.11-30 | 14 | H1_C13_HSQC_Night | e02956op | - | + | - | - | - | + | + | Ref GDB-OP0555-13C_MeCNd3 Group De bo_G | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 30 | 00:33:35 | 20260826-1447-B400_B.11-30 | 13 | H1_Night | e02956op | - | + | - | - | - | + | + | Ref GDB-OP0555-13C_MeCNd3 Group De bo_G | |
| 30 | 00:27:45 | 20260826-1447-B400_B.11-30 | 12 | H1_COSY_Day | e02956op | - | + | - | - | - | + | + | Ref GDB-OP0555-13C_MeCNd3 Group De bo_G | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 30 | 23:31:27 | 20260826-1447-B400_B.11-30 | 11 | C13_CPD_Night1024 | e02956op | + | + | - | + | + | + | + | Ref GDB-OP0555-13C_MeCNd3 Group De bo_G | |
| 42 | 22:34:15 | 20260826-1343-B400_B.11-42 | 11 | C13_CPD_Night1024 | j45159ks | + | + | - | + | + | + | + | Ref nmidep Group Keerthi_A | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 25 | 21:56:14 | 20260826-1209-B400_B.11-25 | 19 | H1_C13_HMBC_Night | e72206ov | + | + | - | + | + | + | + | Ref ov-019.7-b, iPr2O layer Group De bo_G | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 20 | 21:26:44 | 20260826-1143-B400_B.11-20 | 13 | C13_DEPT135_Night | m52750pm | + | + | - | + | + | + | + | Ref GCPM389F1-repe2 Group Crisenza_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 31 | 21:23:15 | 20260826-2111-B400_B.11-31 | 10 | H1_Day | z92209cg | + | + | - | + | + | + | + | Ref ALF201 fuelled 5h30 Group Leigh_D | |
| 29 | 21:09:46 | 20260826-2053-B400_B.11-29 | 11 | H1_COSY_HiRes_Night | y52364mw | - | + | - | - | - | + | + | Ref GDB-MJ-371-COSY Group De bo_G | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 29 | 21:05:17 | 20260826-2053-B400_B.11-29 | 10 | H1_Night | y52364mw | + | + | - | + | + | + | + | Ref GDB-MJ-371-COSY Group De bo_G | |
| 28 | 21:02:09 | 20260826-1954-B400_B.11-28 | 10 | H1_Night128 | f11141tm | + | + | - | x | - | - | - | Ref Cu(Salen)-Mn Chan-Lam 0.9V 1h Group Yang_S | Lock failed after multiple attempts, lock: Command 'lock CDCl3' failed. Lock is OFF, Command 'lock CDCl3' failed. Lock is OFF |
| 27 | 20:59:13 | 20260826-1954-B400_B.11-27 | 10 | H1_Night128 | f11141tm | - | - | - | - | - | - | - | Ref Cu(Salen)-Sm Chan-Lam with lutidine 0.9V 1h Group Yang_S | |
| 26 | 20:43:36 | 20260826-1953-B400_B.11-26 | 10 | H1_Night128 | f11141tm | + | + | - | + | + | + | + | Ref Cu(Salen)-Sm Chan-Lam 0.9V 1h Group Yang_S | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 20 | 19:47:21 | 20260826-1143-B400_B.11-20 | 12 | C13_CPD_Night1024 | m52750pm | + | + | - | + | + | + | + | Ref GCPM389F1-repe2 Group Crisenza_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 29 | 19:44:11 | 20260826-1931-B400_B.11-29 | 10 | H1_Day | z92209cg | + | + | - | + | + | + | + | Ref ALF197 2 fuelled 4d Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 28 | 19:40:54 | 20260826-1931-B400_B.11-28 | 10 | H1_Day | z92209cg | + | + | - | + | + | + | + | Ref ALF196 2 fuelled 4d Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 27 | 19:37:44 | 20260826-1928-B400_B.11-27 | 10 | H1_Day | z92209cg | + | + | - | + | + | + | + | Ref ALF195 2 fuelled 4d Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 26 | 19:34:10 | 20260826-1928-B400_B.11-26 | 10 | H1_Day | z92209cg | + | + | - | + | + | + | + | Ref ALF194 2 fuelled 4d Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 24 | 19:30:53 | 20260826-1926-B400_B.11-24 | 10 | H1_Day | z92209cg | + | + | - | + | + | + | + | Ref ALF201 fuelled 3h30 Group Leigh_D | |
| 22 | 18:55:45 | 20260826-1050-B400_B.11-22 | 14 | H1_C13_HMBC_Night | x06125gb | - | + | - | - | - | + | + | Ref GCGB509F32-42 Group Crisenza_G | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 22 | 18:37:01 | 20260826-1050-B400_B.11-22 | 13 | H1_C13_HSQC_Night | x06125gb | + | + | - | + | + | + | + | Ref GCGB509F32-42 Group Crisenza_G | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 15 | 18:32:55 | 20260826-1740-B400_B.11-15 | 10 | H1_Day | z92209cg | + | + | - | + | + | + | + | Ref ALF201 fuelled 2h30 Group Leigh_D | |
| 18 | 18:28:54 | 20260826-1728-B400_B.11-18 | 10 | H1_Night | y52364mw | + | + | - | + | + | + | + | Ref GDB-MJ-D3-DMAP-heat Group De bo_G | |
| 17 | 18:24:44 | 20260826-1728-B400_B.11-17 | 10 | H1_Night | y52364mw | + | + | - | + | + | + | + | Ref GDB-MJ-371 Group De bo_G | |
| 14 | 18:20:05 | 20260826-1725-B400_B.11-14 | 11 | H1_Night | e72206ov | + | + | - | + | + | + | + | Ref ov-019.7-b, precip on paper, reprecip Group De bo_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 13 | 18:15:17 | 20260826-1722-B400_B.11-13 | 10 | H1_Day | j45108ph | + | + | - | + | + | + | + | Ref ph-770-sec-f2 Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 12 | 18:01:02 | 20260826-1720-B400_B.11-12 | 11 | C13_CPD_Night256 | m52750pm | - | + | - | - | - | + | + | Ref GCPM392Acr-C Group Crisenza_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 12 | 17:56:35 | 20260826-1720-B400_B.11-12 | 10 | H1_Night | m52750pm | + | + | - | + | + | + | + | Ref GCPM392Acr Group Crisenza_G | |
| 7 | 17:41:54 | 20260826-1719-B400_B.11-7 | 11 | C13_CPD_Night256 | m52750pm | - | + | - | - | - | + | + | Ref GCPM391Bcr-C Group Crisenza_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 7 | 17:37:12 | 20260826-1719-B400_B.11-7 | 10 | H1_Night | m52750pm | + | + | - | + | + | + | + | Ref GCPM391Bcr Group Crisenza_G | |
| 2 | 17:33:46 | 20260826-1641-B400_B.11-2 | 10 | H1_Day | w61916tz | + | + | - | + | + | + | + | Ref sy-tz-13-1h-0h Group Yang_S | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 1 | 17:28:46 | 20260826-1705-B400_B.11-1 | 10 | H1_Day | y23702lt | + | + | - | + | + | + | + | Ref LT_AT_OHfull Group Warren_J | |
| 60 | 17:24:04 | 20260826-1637-B400_B.11-60 | 10 | H1_Day | v73981ac | + | + | - | + | + | + | + | Ref IL-AC-ANG-13-pure Group Larrosa_I | |
| 58 | 17:20:54 | 20260826-1601-B400_B.11-43 | 150 | H1_Day | w61916tz | + | + | - | + | + | + | + | Ref sy-tz-24-1h-0h Group Yang_S | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 57 | 17:18:00 | 20260826-1601-B400_B.11-43 | 140 | H1_Day | w61916tz | + | + | - | + | + | + | + | Ref sy-tz-23-1h-0h Group Yang_S | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 56 | 17:14:32 | 20260826-1601-B400_B.11-43 | 130 | H1_Day | w61916tz | + | + | - | + | + | + | + | Ref sy-tz-22-1h-0h Group Yang_S | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 55 | 17:11:12 | 20260826-1634-B400_B.11-55 | 10 | H1_Day | z92209cg | + | + | - | + | + | + | + | Ref AL142 end prod DMSO Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 54 | 17:07:47 | 20260826-1633-B400_B.11-54 | 10 | H1_Day | z92209cg | + | + | - | + | + | + | + | Ref AL142 end prod D2O Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 53 | 17:03:58 | 20260826-1632-B400_B.11-53 | 10 | H1_Day | z92209cg | + | + | - | + | + | + | + | Ref ALF201 fuelled 1h Group Leigh_D | |
| 52 | 17:00:01 | 20260826-1615-B400_B.11-52 | 10 | H1_Day | j45108ph | + | + | - | + | + | + | + | Ref ph-770-sec-f2 Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 51 | 16:54:31 | 20260826-1601-B400_B.11-43 | 90 | H1_Day | w61916tz | + | + | - | + | + | + | + | Ref sy-tz-18-1h-0h Group Yang_S | |
| 50 | 16:51:30 | 20260826-1601-B400_B.11-43 | 80 | H1_Day | w61916tz | + | + | - | + | + | + | + | Ref sy-tz-17-1h-0h Group Yang_S | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 49 | 16:47:45 | 20260826-1601-B400_B.11-43 | 70 | H1_Day | w61916tz | + | + | - | + | + | + | + | Ref sy-tz-16-1h-0h Group Yang_S | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 48 | 16:43:23 | 20260826-1615-B400_B.11-48 | 10 | H1_Day | j45108ph | + | + | - | + | + | + | + | Ref ph-770-sec-f1 Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 47 | 16:39:00 | 20260826-1615-B400_B.11-47 | 10 | H1_Day | j45108ph | + | + | - | + | + | + | + | Ref ph-780-3h Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 46 | 16:32:30 | 20260826-1614-B400_B.11-46 | 10 | H1_Day16 | v73981ac | + | + | - | + | + | + | + | Ref IL-AC-ANG-12-pure Group Larrosa_I | |
| 45 | 16:29:23 | 20260826-1601-B400_B.11-43 | 30 | H1_Day | w61916tz | + | + | - | + | + | + | + | Ref sy-tz-12-1h-0h Group Yang_S | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 44 | 16:26:21 | 20260826-1601-B400_B.11-43 | 20 | H1_Day | w61916tz | + | + | - | + | + | + | + | Ref sy-tz-11-1h-0h Group Yang_S | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 43 | 16:23:12 | 20260826-1601-B400_B.11-43 | 10 | H1_Day | w61916tz | + | + | - | + | + | + | + | Ref sy-tz-10-1h-0h Group Yang_S | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 41 | 16:19:13 | 20260826-1549-B400_B.11-41 | 10 | H1_Day16 | x06125gb | + | + | - | + | + | + | + | Ref GCGBAubagio Group Crisenza_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 40 | 16:13:55 | 20260826-1549-B400_B.11-40 | 10 | H1_Day16 | x06125gb | + | + | - | + | + | + | + | Ref GCGBBiotinMeOD Group Crisenza_G | |
| 39 | 16:10:23 | 20260826-1548-B400_B.11-39 | 10 | H1_Day | z92209cg | + | + | - | + | + | + | + | Ref ALF201 fuelled 15 min Group Leigh_D | |
| 38 | 16:08:05 | 20260826-1542-B400_B.11-38 | 12 | H1_Day16 | h32367lm | - | + | - | - | - | + | + | Ref LM_DC_FCatDel_Col_4-7 Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 38 | 16:05:47 | 20260826-1542-B400_B.11-38 | 11 | H1_Day16 | h32367lm | - | + | - | - | - | + | + | Ref LM_DC_FCatDel_Col_4-7 Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 38 | 15:59:28 | 20260826-1542-B400_B.11-38 | 10 | H1_Day16 | h32367lm | + | + | - | + | + | + | + | Ref LM_DC_FCatDel_Col_4-7 Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 37 | 15:56:17 | 20260826-1532-B400_B.11-37 | 10 | H1_Day | e72206ov | + | + | - | + | + | + | + | Ref ov-019.7-b, filtrate Group De bo_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 36 | 15:52:36 | 20260826-1532-B400_B.11-36 | 10 | H1_Day | e72206ov | + | + | - | + | + | + | + | Ref ov-019.7-b, iPr2O layer, reprecip new layer Group De bo_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 35 | 15:47:33 | 20260826-1529-B400_B.11-34 | 20 | H1_Day16 | p13528bg | + | + | - | + | + | + | + | Ref BG-059 noson 20k peg Group De bo_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 34 | 15:41:33 | 20260826-1529-B400_B.11-34 | 10 | H1_Day16 | p13528bg | + | + | - | + | + | + | + | Ref BG-059 post sonication + Et2O wash Group De bo_G | |
| 33 | 15:38:17 | 20260826-1513-B400_B.11-33 | 10 | H1_Day | z92209cg | + | + | - | + | + | + | + | Ref ALF201 prefuel Group Leigh_D | |
| 32 | 15:32:27 | 20260826-1510-B400_B.11-32 | 11 | H1_COSY_Day | j45108ph | - | + | - | - | - | + | + | Ref ph-779-iso-cosy Group Leigh_D | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 32 | 15:28:23 | 20260826-1510-B400_B.11-32 | 10 | H1_Day | j45108ph | + | + | - | + | + | + | + | Ref ph-779-iso-cosy Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 31 | 15:25:21 | 20260826-1508-B400_B.11-31 | 10 | H1_Day | j45108ph | + | + | - | + | + | + | + | Ref ph-743-3rd-red-L Group Leigh_D 730mg reduction 3 vials | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 30 | 15:21:37 | 20260826-1447-B400_B.11-30 | 10 | H1_Day | e02956op | + | + | - | + | + | + | + | Ref GDB-OP0555-1H_MeCNd3 Group De bo_G | |
| 29 | 15:16:34 | 20260826-1440-B400_B.11-27 | 30 | H1_Day16 | d93111sd | + | + | - | + | + | + | + | Ref IL-SD2-32-c3 Group Larrosa_I | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 28 | 15:11:28 | 20260826-1440-B400_B.11-27 | 20 | H1_Day16 | d93111sd | + | + | - | + | + | + | + | Ref IL-SD2-32-d3 Group Larrosa_I | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 27 | 15:00:52 | 20260826-1440-B400_B.11-27 | 10 | H1_Day16 | d93111sd | + | + | - | + | + | + | + | Ref IL-SD2-32-d1 Group Larrosa_I | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 26 | 14:47:38 | 20260826-1439-B400_B.11-26 | 10 | H1_Quant_D1_25s_Day | z16689fe | + | + | - | + | + | + | + | Ref DJP FE 561 (crude) Group Procter_D | |
| 24 | 14:45:38 | 20260826-1422-B400_B.11-23 | 4040132 | P31_NoCPD_Day | w05220ss | - | + | - | - | - | + | + | Ref JA-SiS-IV-04 Group Abbenseth_J JA-SiS-IV-04 PDNPA - 31P | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 24 | 14:43:54 | 20260826-1422-B400_B.11-23 | 4040131 | P31_Wide_Day | w05220ss | - | + | - | - | - | + | + | Ref JA-SiS-IV-04 Group Abbenseth_J JA-SiS-IV-04 PDNPA - 31P{1H} | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 24 | 14:42:28 | 20260826-1422-B400_B.11-23 | 4040102 | H1_P31CPD_Day | w05220ss | - | + | - | - | - | + | + | Ref JA-SiS-IV-04 Group Abbenseth_J JA-SiS-IV-04 PDNPA - 1H{31P} | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 24 | 14:38:31 | 20260826-1422-B400_B.11-23 | 4040101 | H1_Day16 | w05220ss | + | + | - | + | + | + | + | Ref JA-SiS-IV-04 Group Abbenseth_J JA-SiS-IV-04 PDNPA - 1H | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 23 | 14:36:31 | 20260826-1422-B400_B.11-23 | 4030132 | P31_NoCPD_Day | w05220ss | - | + | - | - | - | + | + | Ref JA-SiS-IV-03 Group Abbenseth_J JA-SiS-IV-04 PDNPA PPh3 - 31P | sref: NUCLEUS '31P' not defined for SOLVENT 'Tol' SR is set to 0.0, sref: NUCLEUS '31P' not defined for SOLVENT 'Tol' SR is set to 0.0 |
| 23 | 14:34:44 | 20260826-1422-B400_B.11-23 | 4030131 | P31_Wide_Day | w05220ss | - | + | - | - | - | + | + | Ref JA-SiS-IV-03 Group Abbenseth_J JA-SiS-IV-04 PDNPA PPh3 - 31P{1H} | sref: NUCLEUS '31P' not defined for SOLVENT 'Tol' SR is set to 0.0, sref: NUCLEUS '31P' not defined for SOLVENT 'Tol' SR is set to 0.0 |
| 23 | 14:32:30 | 20260826-1422-B400_B.11-23 | 4030102 | H1_P31CPD_Day | w05220ss | - | + | - | - | - | + | + | Ref JA-SiS-IV-03 Group Abbenseth_J JA-SiS-IV-04 PDNPA PPh3 - 1H{1H} | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 23 | 14:28:01 | 20260826-1422-B400_B.11-23 | 4030101 | H1_Day16 | w05220ss | + | + | - | + | + | + | + | Ref JA-SiS-IV-03 Group Abbenseth_J JA-SiS-IV-04 PDNPA PPh3 - 1H | |
| 21 | 14:24:24 | 20260826-1147-B400_B.11-21 | 10 | H1_Day | z92209cg | + | + | - | + | + | + | + | Ref AL142 2 sample2 1week Group Leigh_D no extra Pt added on this one | |
| 19 | 14:09:57 | 20260826-1029-B400_B.11-19 | 10 | H1_Night128 | f11141tm | + | + | - | + | + | + | + | Ref Cu(Salen)-Gd LiBr 2mL toluene 5mA 1h dry again Group Yang_S | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 40 | 14:00:07 | 20260826-1328-B400_B.11-40 | 13 | F19_NoCPD_Night | q20548kk | + | + | - | + | + | + | + | Ref ak-kk-hatf6-rpt Group Keerthi_A | log_err: acqt0 not set in pulse program, result may be incorrect!, log_err: acqt0 not set in pulse program, result may be incorrect!, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0 |
| 42 | 13:54:59 | 20260826-1343-B400_B.11-42 | 10 | H1_Day16 | j45159ks | + | + | - | + | + | + | + | Ref nmidep Group Keerthi_A | |
| 41 | 13:50:51 | 20260826-1342-B400_B.11-41 | 10 | F19_NoCPD_Day | j26946hi | + | + | - | + | + | + | + | Ref AT-HI-2-18F Group Trowbridge_A | log_err: acqt0 not set in pulse program, result may be incorrect!, log_err: acqt0 not set in pulse program, result may be incorrect!, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0 |
| 40 | 13:48:35 | 20260826-1328-B400_B.11-40 | 12 | F19_NoCPD_Day | q20548kk | - | + | - | - | - | + | + | Ref ak-kk-hatf6-rpt Group Keerthi_A | log_err: acqt0 not set in pulse program, result may be incorrect!, log_err: acqt0 not set in pulse program, result may be incorrect!, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0 |
| 40 | 13:46:40 | 20260826-1328-B400_B.11-40 | 11 | C13_CPD_Day | q20548kk | - | + | - | - | - | + | + | Ref ak-kk-hatf6-rpt Group Keerthi_A | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 40 | 13:42:12 | 20260826-1328-B400_B.11-40 | 10 | H1_Day | q20548kk | + | + | - | + | + | + | + | Ref ak-kk-hatf6-rpt Group Keerthi_A | |
| 27 | 13:38:10 | 20260826-1331-B400_B.11-27 | 10000001 | H1_Day | w05220ss | + | + | - | + | + | + | + | Ref JA-SiRi-Murali Group Abbenseth_J SiRi Murali sample | |
| 26 | 13:33:18 | 20260826-1327-B400_B.11-26 | 10 | H1_Day | z16689fe | + | + | - | + | + | + | + | Ref DJP TL 055rs Group Procter_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 25 | 13:17:56 | 20260826-1209-B400_B.11-25 | 18 | H1_C13_HSQC_Night | e72206ov | - | + | - | - | - | + | + | Ref ov-019.7-b, iPr2O layer Group De bo_G | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 25 | 13:02:28 | 20260826-1209-B400_B.11-25 | 17 | H1_COSY_HiRes_Night | e72206ov | + | + | - | + | + | + | + | Ref ov-019.7-b, iPr2O layer Group De bo_G | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 27 | 12:59:26 | 20260826-1245-B400_B.11-27 | 10 | H1_Day | e72206ov | + | + | - | + | + | + | + | Ref ov-019.7-b, left in vial after pour and iPr2O wash Group De bo_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 26 | 12:55:15 | 20260826-1245-B400_B.11-26 | 10 | H1_Day | e72206ov | + | + | - | + | + | + | + | Ref ov-019.7-b, mili pap precip Group De bo_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 25 | 12:53:57 | 20260826-1209-B400_B.11-25 | 16 | H1_Day | e72206ov | - | + | - | - | - | + | + | Ref ov-019.7-b, iPr2O layer Group De bo_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 25 | 12:39:41 | 20260826-1209-B400_B.11-25 | 12 | C13_CPD_Night256 | e72206ov | - | + | - | - | - | + | + | Ref ov-019.7-b, iPr2O layer Group De bo_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 25 | 12:34:15 | 20260826-1209-B400_B.11-25 | 11 | H1_Night | e72206ov | + | + | - | + | + | + | + | Ref ov-019.7-b, iPr2O layer Group De bo_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 50 | 12:27:59 | 20260826-1145-B400_B.11-50 | 10 | H1_Day16 | m49300gs | + | + | - | + | + | + | + | Ref pyrene-car-et-cdcl3 Group Yang_S | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 27 | 12:24:27 | 20260826-1214-B400_B.11-27 | 10 | H1_Day | z92209cg | + | + | - | + | + | + | + | Ref ALF200 fuelled 1d Group Leigh_D 2mg cage added | |
| 26 | 12:19:39 | 20260826-1210-B400_B.11-26 | 10 | H1_Day16 | mbdxkrn2 | + | + | - | + | + | + | + | Ref GDB-RN Si Prep Thing - Acetone-d6 Group De bo_G | |
| 25 | 12:15:16 | 20260826-1209-B400_B.11-25 | 10 | H1_Day | e72206ov | + | + | - | + | + | + | + | Ref ov-019.7-b, iPr2O layer Group De bo_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 24 | 12:11:05 | 20260826-1150-B400_B.11-24 | 10 | H1_Day | z88883sp | + | + | - | + | + | + | + | Ref SP438e Group Romanov_A Column fr1-2 | |
| 23 | 12:06:04 | 20260826-1150-B400_B.11-23 | 10 | H1_Day | z88883sp | + | + | - | + | + | + | + | Ref SP427h Group Romanov_A Borylation batch 2 recryst crop 1 | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 21 | 12:02:40 | 20260826-1147-B400_B.11-21 | 10 | H1_Day | z92209cg | + | + | - | + | + | + | + | Ref AL142 2 1week Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 20 | 12:00:42 | 20260826-1143-B400_B.11-20 | 11 | C13_CPD_Day | m52750pm | - | + | - | - | - | + | + | Ref GCPM389F1-repe2 Group Crisenza_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 20 | 11:57:19 | 20260826-1143-B400_B.11-20 | 10 | H1_Day | m52750pm | + | + | - | + | + | + | + | Ref GCPM389F1-repe2 Group Crisenza_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 18 | 11:42:52 | 20260826-1029-B400_B.11-18 | 10 | H1_Night128 | f11141tm | + | + | - | + | + | + | + | Ref Cu(Salen)-La LiBr 2mL cyclohexane 5mA 1h dry again Group Yang_S | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 24 | 11:38:37 | 20260826-1124-B400_B.11-24 | 10 | H1_Day16 | p13528bg | + | + | - | + | + | + | + | Ref BG-040b) post extraction Group De bo_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 23 | 11:33:39 | 20260826-1123-B400_B.11-23 | 10 | H1_Day16 | p13528bg | + | + | - | + | + | + | + | Ref BG-061 crude post crash Group De bo_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 22 | 11:20:06 | 20260826-1050-B400_B.11-22 | 12 | H1_COSY_HiRes_Night | x06125gb | - | + | - | - | - | + | + | Ref GCGB509F32-42 Group Crisenza_G | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 22 | 11:05:13 | 20260826-1050-B400_B.11-22 | 11 | C13_CPD_Night256 | x06125gb | - | + | - | - | - | + | + | Ref GCGB509F32-42 Group Crisenza_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 22 | 11:00:50 | 20260826-1050-B400_B.11-22 | 10 | H1_Night | x06125gb | + | + | - | + | + | + | + | Ref GCGB509F32-42 Group Crisenza_G | |
| 21 | 10:53:47 | 20260826-1035-B400_B.11-21 | 3920401 | H1_Day16 | w05220ss | + | + | - | + | + | + | + | Ref JA-SiS-III-92 Group Abbenseth_J JA-SiS-III-92 BnBr NH3 - redissolved in CDCl3 - 1H | |
| 20 | 10:51:47 | 20260826-1034-B400_B.11-20 | 3910432 | P31_NoCPD_Day | w05220ss | - | + | - | - | - | + | + | Ref JA-SiS-III-91 Group Abbenseth_J JA-SiS-III-91 P(DNPA) after additional DNPA - 31P | sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0 |
| 20 | 10:50:03 | 20260826-1034-B400_B.11-20 | 3910431 | P31_Wide_Day | w05220ss | - | + | - | - | - | + | + | Ref JA-SiS-III-91 Group Abbenseth_J JA-SiS-III-91 P(DNPA) after additional DNPA - 31P{1H} | sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0 |
| 20 | 10:44:04 | 20260826-1034-B400_B.11-20 | 3910401 | H1_Day16 | w05220ss | + | + | - | + | + | + | + | Ref JA-SiS-III-91 Group Abbenseth_J JA-SiS-III-91 P(DNPA) after additional DNPA - 1H | |
| 17 | 10:29:28 | 20260826-1028-B400_B.11-17 | 10 | H1_Night128 | f11141tm | + | + | - | + | + | + | + | Ref Cu(Salen)-La LiBr 2mL toluene 5mA 1h dry again Group Yang_S | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 4 | 10:20:38 | 20260826-1016-B400_B.11-4 | 10 | H1_Day16 | x06125gb | + | + | - | + | + | + | + | Ref GCGB512F32-42 Group Crisenza_G | |
| 3 | 10:17:19 | 20260826-1015-B400_B.11-3 | 10 | H1_Day | z92209cg | + | + | - | + | + | + | + | Ref ALF200 fuelling 20h Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 2 | 10:13:07 | 20260826-1007-B400_B.11-1 | 20 | H1_Day16 | d08103sl | + | + | - | + | + | + | + | Ref sl-se-10-1-1 d Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 1 | 10:08:25 | 20260826-1007-B400_B.11-1 | 10 | H1_Day16 | d08103sl | + | + | - | + | + | + | + | Ref sl-se-11 Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 29 | 09:11:31 | 20260826-0844-B400_B.11-17 | 70 | H1_Day | x06125gb | + | + | - | + | + | + | + | Ref GCGB512Fl Group Crisenza_G | |
| 25 | 09:07:22 | 20260826-0844-B400_B.11-17 | 60 | H1_Day | x06125gb | + | + | - | + | + | + | + | Ref GCGB512F55-74 Group Crisenza_G | |
| 24 | 09:04:13 | 20260826-0844-B400_B.11-17 | 50 | H1_Day | x06125gb | + | + | - | + | + | + | + | Ref GCGB512F1-3 Group Crisenza_G | |
| 23 | 08:59:50 | 20260826-0844-B400_B.11-17 | 40 | H1_Day | x06125gb | + | + | - | + | + | + | + | Ref GCGB501Cr Group Crisenza_G | |
| 19 | 08:56:36 | 20260826-0844-B400_B.11-17 | 30 | H1_Day | x06125gb | + | + | - | + | + | + | + | Ref GCGB509Pr2 Group Crisenza_G | |
| 18 | 08:52:07 | 20260826-0844-B400_B.11-17 | 20 | H1_Day | x06125gb | + | + | - | + | + | + | + | Ref GCGB509Pr1 Group Crisenza_G | |
| 17 | 08:48:19 | 20260826-0844-B400_B.11-17 | 10 | H1_Day | x06125gb | + | + | - | + | + | + | + | Ref GCGB513Cr Group Crisenza_G | |
| 3 | 08:24:08 | 20260826-0805-B400_B.11-2 | 3910332 | P31_NoCPD_Day | w05220ss | - | + | - | - | - | + | + | Ref JA-SiS-III-91 Group Abbenseth_J JA-SiS-III-91 P-DNPA - 31P | sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0 |
| 3 | 08:22:24 | 20260826-0805-B400_B.11-2 | 3910331 | P31_Wide_Day | w05220ss | - | + | - | - | - | + | + | Ref JA-SiS-III-91 Group Abbenseth_J JA-SiS-III-91 P-DNPA - 31P{1H} | sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0 |
| 3 | 08:16:59 | 20260826-0805-B400_B.11-2 | 3910301 | H1_Day16 | w05220ss | + | + | - | + | + | + | + | Ref JA-SiS-III-91 Group Abbenseth_J JA-SiS-III-91 P-DNPA - 1H | |
| 2 | 08:14:59 | 20260826-0805-B400_B.11-2 | 4020232 | P31_NoCPD_Day | w05220ss | - | + | - | - | - | + | + | Ref JA-SiS-IV-02 Group Abbenseth_J JA-SiS-IV-02 MeOPhN=P - 31P | sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0 |
| 2 | 08:12:33 | 20260826-0805-B400_B.11-2 | 4020231 | P31_Wide_Day | w05220ss | - | + | - | - | - | + | + | Ref JA-SiS-IV-02 Group Abbenseth_J JA-SiS-IV-02 MeOPhN=P - 31P{1H} | sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0 |
| 2 | 08:07:12 | 20260826-0805-B400_B.11-2 | 4020201 | H1_Day16 | w05220ss | + | + | - | + | + | + | + | Ref JA-SiS-IV-02 Group Abbenseth_J JA-SiS-IV-02 MeOPhN=P - 1H | |
| 52 | 23:33:35 | 20260825-2301-B400_B.11-51 | 20 | H1_Night128 | m09677nb | + | + | - | + | + | + | + | Ref 547 Group Greaney_M | |
| 51 | 23:01:47 | 20260825-2301-B400_B.11-51 | 10 | H1_Night128 | m09677nb | + | + | - | + | + | + | + | Ref 548 Group Greaney_M | |
| 47 | 21:26:11 | 20260825-2017-B400_B.11-47 | 10 | H1_Night128 | f11141tm | + | + | - | + | + | + | + | Ref Cu(Salen)-La LiBr 2mL cyclohexane 5mA 1h with 100ul junsanjiaben Group Yang_S | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 46 | 21:12:26 | 20260825-2016-B400_B.11-46 | 10 | H1_Night128 | f11141tm | + | + | - | + | + | + | + | Ref Cu(Salen)-Zn LiBr 2mL toluene 5mA 1h with 100ul junsanjiaben Group Yang_S | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 45 | 20:57:58 | 20260825-2016-B400_B.11-45 | 10 | H1_Night128 | f11141tm | + | + | - | + | + | + | + | Ref Cu(Salen)-Cu LiBr 2mL toluene 5mA 1h with 100ul junsanjiaben Group Yang_S | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 44 | 20:44:13 | 20260825-2016-B400_B.11-44 | 10 | H1_Night128 | f11141tm | + | + | - | + | + | + | + | Ref Cu(Salen)-Mn LiBr 2mL toluene 5mA 1h with 100ul junsanjiaben Group Yang_S | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 43 | 20:30:29 | 20260825-2016-B400_B.11-43 | 10 | H1_Night128 | f11141tm | + | + | - | + | + | + | + | Ref Cu(Salen)-Gd LiBr 2mL toluene 5mA 1h with 100ul junsanjiaben Group Yang_S | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 42 | 20:16:06 | 20260825-2015-B400_B.11-42 | 10 | H1_Night128 | f11141tm | + | + | - | + | + | + | + | Ref Cu(Salen)-La LiBr 2mL toluene 5mA 1h with 100ul junsanjiaben Group Yang_S | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 4 | 20:01:37 | 20260825-1819-B400_B.11-4 | 10 | H1_Day | z92209cg | + | + | - | + | + | + | + | Ref ALF200 fuelled 6h Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 37 | 19:49:08 | 20260825-1948-B400_B.11-37 | 10 | H1_Day | j45108ph | + | + | - | + | + | + | + | Ref ph-779-iso Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 1 | 19:23:21 | 20260825-1547-B400_B.11-1 | 12 | H1_Day16 | d08103sl | + | + | - | + | + | + | + | Ref sl-se-11 Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 3 | 18:45:49 | 20260825-1718-B400_B.11-3 | 12 | C13_DEPT135_Night | z88883sp | + | + | - | + | + | + | + | Ref SP437k1 Group Romanov_A Recryst | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 4 | 18:42:04 | 20260825-1819-B400_B.11-4 | 10 | H1_Day | z92209cg | + | + | - | + | + | + | + | Ref ALF200 fuelled 5h Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 3 | 17:47:42 | 20260825-1718-B400_B.11-3 | 11 | C13_CPD_Night1024 | z88883sp | - | + | - | - | - | + | + | Ref SP437k1 Group Romanov_A Recryst | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 3 | 17:32:53 | 20260825-1718-B400_B.11-3 | 10 | H1_Night128 | z88883sp | + | + | - | + | + | + | + | Ref SP437k1 Group Romanov_A Recryst | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 4 | 17:27:20 | 20260825-1719-B400_B.11-4 | 10 | H1_Day | j82494jb | + | + | - | + | + | + | + | Ref QBB-G142-1hr Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 2 | 17:23:13 | 20260825-1547-B400_B.11-1 | 21 | H1_Day16 | d08103sl | + | + | - | + | + | + | + | Ref sl-se-10-1-3 h Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 1 | 17:18:19 | 20260825-1547-B400_B.11-1 | 11 | H1_Day16 | d08103sl | + | + | - | + | + | + | + | Ref sl-se-10-2-3 h Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 36 | 17:13:41 | 20260825-1701-B400_B.11-36 | 11 | H1_Day | x26213ll | - | + | - | - | - | + | + | Ref 260825-ligand-4 Group Yang_S | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 36 | 17:04:38 | 20260825-1701-B400_B.11-36 | 10 | H1_WaterSupp_Day | x26213ll | + | + | - | + | + | + | + | Ref 260825-ligand-4 Group Yang_S | |
| 35 | 17:00:35 | 20260825-1659-B400_B.11-35 | 10 | H1_Day | a44936mc | + | + | - | + | + | + | + | Ref mc152-click-p Group Leigh_D | |
| 34 | 16:47:59 | 20260825-1646-B400_B.11-34 | 10 | H1_Day | z92209cg | + | + | - | + | + | + | + | Ref ALF200 fuelled 2h30 Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 33 | 16:44:23 | 20260825-1643-B400_B.11-33 | 10 | H1_Day | a91398js | + | + | - | + | + | + | + | Ref JaS_FeM_48_2_F1 Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 32 | 16:28:20 | 20260825-1608-B400_B.11-32 | 3920301 | H1_Day16 | w05220ss | + | + | - | + | + | + | + | Ref JA-SiS-III-92 Group Abbenseth_J JA-SiS-III-92 after solvent removal | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 31 | 16:26:20 | 20260825-1606-B400_B.11-31 | 4020132 | P31_NoCPD_Day | w05220ss | - | + | - | - | - | + | + | Ref JA-SiS-IV-02 Group Abbenseth_J JA-SiS-IV-02 MeOPhN=P -31P | sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0 |
| 31 | 16:24:33 | 20260825-1606-B400_B.11-31 | 4020131 | P31_Wide_Day | w05220ss | - | + | - | - | - | + | + | Ref JA-SiS-IV-02 Group Abbenseth_J JA-SiS-IV-02 MeOPhN=P -31P{1H} | sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0 |
| 31 | 16:22:13 | 20260825-1606-B400_B.11-31 | 4020102 | H1_P31CPD_Day | w05220ss | - | + | - | - | - | + | + | Ref JA-SiS-IV-02 Group Abbenseth_J JA-SiS-IV-02 MeOPhN=P -1H{31P} | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 31 | 16:16:20 | 20260825-1606-B400_B.11-31 | 4020101 | H1_Day16 | w05220ss | + | + | - | + | + | + | + | Ref JA-SiS-IV-02 Group Abbenseth_J JA-SiS-IV-02 MeOPhN=P -1H | |
| 30 | 16:01:11 | 20260825-1507-B400_B.11-30 | 12 | B11_CPD_Night | j88755sb | - | + | - | - | - | + | + | Ref capg-sb071-A-B Group Goodwin_C | sref: NUCLEUS '11B' not defined for SOLVENT 'C6D6' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Goodwin_C/data/j88755sb/nmr/20260825-1507-B400_B.11-30/12/pdata/1/peaks!, sref: NUCLEUS '11B' not defined for SOLVENT 'C6D6' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Goodwin_C/data/j88755sb/nmr/20260825-1507-B400_B.11-30/12/pdata/1/peaks! |
| 30 | 15:57:19 | 20260825-1507-B400_B.11-30 | 11 | B11_NoCPD_Day | j88755sb | + | + | - | + | + | + | + | Ref capg-sb071-A-B Group Goodwin_C | log_err: acqt0 not set in pulse program, result may be incorrect!, log_err: acqt0 not set in pulse program, result may be incorrect!, sref: NUCLEUS '11B' not defined for SOLVENT 'C6D6' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Goodwin_C/data/j88755sb/nmr/20260825-1507-B400_B.11-30/11/pdata/1/peaks!, sref: NUCLEUS '11B' not defined for SOLVENT 'C6D6' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Goodwin_C/data/j88755sb/nmr/20260825-1507-B400_B.11-30/11/pdata/1/peaks! |
| 2 | 15:53:20 | 20260825-1547-B400_B.11-1 | 20 | H1_Day16 | d08103sl | + | + | - | + | + | + | + | Ref sl-se-10-1-2 h Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 1 | 15:48:59 | 20260825-1547-B400_B.11-1 | 10 | H1_Day16 | d08103sl | + | + | - | + | + | + | + | Ref sl-se-10-2-2 h Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 32 | 15:33:12 | 20260825-1529-B400_B.11-32 | 11 | C13_CPD_Day | u67812sg | - | + | - | - | - | + | + | Ref sq-2-75 Group Procter_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 32 | 15:29:36 | 20260825-1529-B400_B.11-32 | 10 | H1_Day | u67812sg | + | + | - | + | + | + | + | Ref sq-2-75 Group Procter_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 27 | 15:17:17 | 20260825-1412-B400_B.11-27 | 10 | H1_Day | z92209cg | + | + | - | + | + | + | + | Ref ALF200 fuelled 1h Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 30 | 15:08:23 | 20260825-1507-B400_B.11-30 | 10 | B11_CPD_Day | j88755sb | + | + | - | + | + | + | + | Ref capg-sb071-A-B Group Goodwin_C | sref: NUCLEUS '11B' not defined for SOLVENT 'C6D6' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Goodwin_C/data/j88755sb/nmr/20260825-1507-B400_B.11-30/10/pdata/1/peaks!, sref: NUCLEUS '11B' not defined for SOLVENT 'C6D6' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Goodwin_C/data/j88755sb/nmr/20260825-1507-B400_B.11-30/10/pdata/1/peaks! |
| 29 | 15:06:23 | 20260825-1454-B400_B.11-29 | 12 | P31_NoCPD_Day | p27065cs | - | + | - | - | - | + | + | Ref CS31_2 Group Goodwin_C | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 29 | 15:03:57 | 20260825-1454-B400_B.11-29 | 11 | P31_CPD_Day | p27065cs | - | + | - | - | - | + | + | Ref CS31_2 Group Goodwin_C | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 29 | 14:59:23 | 20260825-1454-B400_B.11-29 | 10 | H1_Day16 | p27065cs | + | + | - | + | + | + | + | Ref CS31_2 Group Goodwin_C | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 28 | 14:55:37 | 20260825-1411-B400_B.11-28 | 11 | H1_Day | e72206ov | + | + | - | + | + | + | + | Ref 2,6-pyridinedicarboxaldehyde after mini col Group De bo_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 27 | 14:45:15 | 20260825-1412-B400_B.11-27 | 10 | H1_Day | z92209cg | + | + | - | + | + | + | + | Ref ALF200 fuelled 30min Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 27 | 14:13:11 | 20260825-1412-B400_B.11-27 | 10 | H1_Day | z92209cg | + | + | - | + | + | + | + | Ref ALF200 fuelled 5min Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 26 | 14:09:02 | 20260825-1349-B400_B.11-26 | 10 | H1_Day16 | y52364mw | + | + | - | + | + | + | + | Ref GDB-MJ-371-reaction-heat Group De bo_G | |
| 25 | 14:04:19 | 20260825-1349-B400_B.11-25 | 10 | H1_Day16 | y52364mw | + | + | - | + | + | + | + | Ref GDB-MJ-371-reaction-rt Group De bo_G | |
| 24 | 14:00:53 | 20260825-1348-B400_B.11-24 | 10 | H1_Day | z92209cg | + | + | - | + | + | + | + | Ref ALF197 2 fuelled 3d Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 23 | 13:57:52 | 20260825-1348-B400_B.11-23 | 10 | H1_Day | z92209cg | + | + | - | + | + | + | + | Ref ALF196 2 fuelled 3d Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 22 | 13:54:41 | 20260825-1347-B400_B.11-22 | 10 | H1_Day | z92209cg | + | + | - | + | + | + | + | Ref ALF195 fuelled 3d Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 21 | 13:51:38 | 20260825-1347-B400_B.11-21 | 10 | H1_Day | z92209cg | + | + | - | + | + | + | + | Ref ALF194 2 fuelled 3d Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 20 | 13:48:20 | 20260825-1346-B400_B.11-20 | 10 | H1_Day | z92209cg | + | + | - | + | + | + | + | Ref ALF200 prefuel Group Leigh_D ALF200 prefuel | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 19 | 13:43:27 | 20260825-1339-B400_B.11-19 | 10 | H1_Day | e72206ov | + | + | - | + | + | + | + | Ref ov-006-c, cis + lil bit of trans post sep after mix Group De bo_G | |
| 18 | 13:39:46 | 20260825-1339-B400_B.11-18 | 10 | H1_Day | e72206ov | + | + | - | + | + | + | + | Ref ov-015-e, post rep ep after mix Group De bo_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 17 | 11:58:26 | 20260825-1138-B400_B.11-17 | 10 | C13_CPD_Day | z16689fe | + | + | - | + | + | + | + | Ref DJP FE 560 Group Procter_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 15 | 11:56:19 | 20260825-1133-B400_B.11-15 | 11 | F19_NoCPD_Day | x06125gb | - | + | - | - | - | + | + | Ref GCGBBiotingRO Group Crisenza_G | log_err: acqt0 not set in pulse program, result may be incorrect!, log_err: acqt0 not set in pulse program, result may be incorrect!, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0 |
| 15 | 11:50:56 | 20260825-1133-B400_B.11-15 | 10 | H1_Day16 | x06125gb | + | + | - | + | + | + | + | Ref GCGBBiotingRO Group Crisenza_G | |
| 14 | 11:45:31 | 20260825-1112-B400_B.11-14 | 10 | H1_Day16 | h32367lm | + | + | - | + | + | + | + | Ref LM_FCat_LiAlH4_10min Group Leigh_D | |
| 13 | 11:39:13 | 20260825-1110-B400_B.11-13 | 11 | H1_Day16 | h32367lm | + | + | - | + | + | + | + | Ref LM_FCat_LiAlH4_ON Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 12 | 11:34:44 | 20260825-1105-B400_B.11-12 | 10 | H1_Day | z83527ql | + | + | - | + | + | + | + | Ref QLU-Ar-ester-004 crude Group Leigh_D | |
| 11 | 11:28:54 | 20260825-1101-B400_B.11-11 | 15 | H1_COSY_Day | m46745sw | - | + | - | - | - | + | + | Ref 109-p-cosy Group Natrajan_L | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 11 | 11:27:41 | 20260825-1101-B400_B.11-11 | 14 | H1_Day | m46745sw | - | + | - | - | - | + | + | Ref 109-p Group Natrajan_L | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 11 | 11:25:46 | 20260825-1101-B400_B.11-11 | 13 | C13_CPD_Day | m46745sw | - | + | - | - | - | + | + | Ref 109-p-c Group Natrajan_L | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 11 | 11:20:25 | 20260825-1101-B400_B.11-11 | 10 | H1_Day16 | m46745sw | + | + | - | + | + | + | + | Ref 109-p Group Natrajan_L | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 10 | 11:16:39 | 20260825-1100-B400_B.11-10 | 10 | H1_Day | z16689fe | + | + | - | + | + | + | + | Ref DJP FE 560 Group Procter_D columned | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 9 | 11:12:58 | 20260825-1059-B400_B.11-9 | 10 | H1_Day | j45108ph | + | + | - | + | + | + | + | Ref ph-742-3rd-red Group Leigh_D red after ether wash | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 8 | 11:08:10 | 20260825-1058-B400_B.11-8 | 10 | H1_Day | j82494jb | + | + | - | + | + | + | + | Ref QBB-G140-2hrs Group Leigh_D | |
| 7 | 11:05:29 | 20260825-1044-B400_B.11-7 | 11 | C13_CPD_Day | u67812sg | - | + | - | - | - | + | + | Ref sq-2-73-2 Group Procter_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 7 | 11:01:11 | 20260825-1044-B400_B.11-7 | 10 | H1_Day | u67812sg | + | + | - | + | + | + | + | Ref sq-2-73-2 Group Procter_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 6 | 10:53:53 | 20260825-1038-B400_B.11-6 | 10 | H1_Day16 | h32367lm | + | + | - | + | + | + | + | Ref LM_FCat_LiALH4_ON Group Leigh_D | |
| 5 | 10:48:54 | 20260825-1038-B400_B.11-5 | 11 | H1_Day16 | h32367lm | + | + | - | + | + | + | + | Ref LM_FCat_BH3_ON Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 4 | 10:44:50 | 20260825-1037-B400_B.11-3 | 20 | H1_Day16 | d08103sl | + | + | - | + | + | + | + | Ref sl-9-1-0 h Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 3 | 10:39:59 | 20260825-1037-B400_B.11-3 | 10 | H1_Day16 | d08103sl | + | + | - | + | + | + | + | Ref sl-9-2-0 h Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 2 | 10:34:43 | 20260825-1032-B400_B.11-2 | 10 | H1_Day16 | z92209cg | + | + | - | + | + | + | + | Ref gck-014-wp-crude Group Leigh_D | |
| 1 | 10:30:08 | 20260825-1028-B400_B.11-1 | 10 | H1_Day16 | p13528bg | + | + | - | + | + | + | + | Ref BG-060 col2 combined tt40-49 Group De bo_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 8 | 10:06:39 | 20260825-1005-B400_B.11-8 | 10 | H1_Day16 | x06125gb | + | + | - | + | + | + | + | Ref GCGB506Pr Group Crisenza_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 2 | 09:19:33 | 20260825-0904-B400_B.11-2 | 3880332 | P31_NoCPD_Day | w05220ss | - | + | - | - | - | + | + | Ref JA-SuS-III-88 Group Abbenseth_J JA-SuS-III-88 P Ph-vinyl-sulfone - 31P | sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0; pp: Cannot find any peak for scaling in /mnt/nmrdata/Abbenseth_J/data/w05220ss/nmr/20260825-0904-B400_B.11-2/3880332/pdata/1/peaks!, sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0; pp: Cannot find any peak for scaling in /mnt/nmrdata/Abbenseth_J/data/w05220ss/nmr/20260825-0904-B400_B.11-2/3880332/pdata/1/peaks! |
| 2 | 09:14:15 | 20260825-0904-B400_B.11-2 | 3880331 | P31_Wide_Day | w05220ss | + | + | - | + | + | + | + | Ref JA-SuS-III-88 Group Abbenseth_J JA-SuS-III-88 P Ph-vinyl-sulfone - 31P{1H} | sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0 |
| 1 | 09:00:00 | 20260824-1047-B400_B.11-1 | 10 | H1_make_shim.icon | service | + | + | - | + | + | + | + | Ref sucose shim Group Service | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 23 | 08:47:30 | 20260825-0846-B400_B.11-23 | 10 | H1_Day16 | a91398js | + | + | - | + | + | + | + | Ref JaS_FeM_49_crude Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 2 | 08:26:47 | 20260825-0819-B400_B.11-2 | 32 | P31_NoCPD_Day | w05220ss | - | + | - | - | - | + | + | Ref JA-SiS-Ph3P Group Abbenseth_J JA-SiS-Ph3P 31P | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 2 | 08:25:04 | 20260825-0819-B400_B.11-2 | 31 | P31_Wide_Day | w05220ss | - | + | - | - | - | + | + | Ref JA-SiS-Ph3P Group Abbenseth_J JA-SiS-Ph3P 31P{1H} | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 2 | 08:20:55 | 20260825-0819-B400_B.11-2 | 1 | H1_Day16 | w05220ss | + | + | - | + | + | + | + | Ref JA-SiS-Ph3P Group Abbenseth_J JA-SiS-Ph3P 1H | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 31 | 07:52:55 | 20260825-0752-B400_B.11-31 | 10 | H1_Day16 | mbdxkrn2 | + | + | - | + | + | + | + | Ref GDB-RN1220 Old - Basic CDCl3 Group De bo_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 18 | 07:45:43 | 20260825-0724-B400_B.11-18 | 3880301 | H1_Day16 | w05220ss | + | + | - | + | + | + | + | Ref JA-SiS-III-88 Group Abbenseth_J JA-SiS-III-88 P Ph-vinyl-sulfone - 1H | |
| 17 | 07:44:17 | 20260825-0722-B400_B.11-15 | 3910232 | P31_NoCPD_Day | w05220ss | - | + | - | - | - | + | + | Ref JA-SiS-III-91 Group Abbenseth_J JA-SiS-III-91 P-DNPA- 31P | sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0 |
| 17 | 07:42:21 | 20260825-0722-B400_B.11-15 | 3910231 | P31_Wide_Day | w05220ss | - | + | - | - | - | + | + | Ref JA-SiS-III-91 Group Abbenseth_J JA-SiS-III-91 P-DNPA- 31P{1H} | sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0 |
| 17 | 07:35:07 | 20260825-0722-B400_B.11-15 | 3910201 | H1_Day16 | w05220ss | + | + | - | + | + | + | + | Ref JA-SiS-III-91 Group Abbenseth_J JA-SiS-III-91 P-DNPA- 1H | |
| 15 | 07:30:32 | 20260825-0722-B400_B.11-15 | 3920201 | H1_Day16 | w05220ss | + | + | - | + | + | + | + | Ref JA-SiS-III-92 Group Abbenseth_J JA-SiS-III-92 BnBr NH3 - white solid preicpitated - 1H | |
| 14 | 07:29:06 | 20260825-0720-B400_B.11-14 | 4010232 | P31_NoCPD_Day | w05220ss | - | + | - | - | - | + | + | Ref JA-SiS-IV-01 Group Abbenseth_J JA-SiS-IV-01 DippN=N - slightly yellow - 31P | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 14 | 07:26:42 | 20260825-0720-B400_B.11-14 | 4010231 | P31_Wide_Day | w05220ss | - | + | - | - | - | + | + | Ref JA-SiS-IV-01 Group Abbenseth_J JA-SiS-IV-01 DippN=N - slightly yellow - 31P{1H} | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 14 | 07:22:01 | 20260825-0720-B400_B.11-14 | 4010201 | H1_Day16 | w05220ss | + | + | - | + | + | + | + | Ref JA-SiS-IV-01 Group Abbenseth_J JA-SiS-IV-01 DippN=N - slightly yellow - 1H | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 13 | 00:59:27 | 20260824-2005-B400_B.11-13 | 15 | H1_NOESY_US_Night | n04147ed | - | + | - | - | - | + | + | Ref ED-03-129-F3 Group James_M | |
| 13 | 00:24:18 | 20260824-2005-B400_B.11-13 | 14 | H1_C13_HMBC_Night | n04147ed | - | + | - | - | - | + | + | Ref ED-03-129-F3 Group James_M | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 13 | 00:08:56 | 20260824-2005-B400_B.11-13 | 13 | H1_C13_HSQC_Night | n04147ed | - | + | - | - | - | + | + | Ref ED-03-129-F3 Group James_M | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 13 | 23:51:38 | 20260824-2005-B400_B.11-13 | 12 | H1_COSY_HiRes_Night | n04147ed | + | + | - | + | + | + | + | Ref ED-03-129-F3 Group James_M | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 22 | 23:47:13 | 20260824-2338-B400_B.11-22 | 10 | H1_Day | j45108ph | + | + | - | + | + | + | + | Ref ph-769-fuel Group Leigh_D 24 aug | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 13 | 23:32:54 | 20260824-2005-B400_B.11-13 | 11 | C13_CPD_Night256 | n04147ed | - | + | - | - | - | + | + | Ref ED-03-129-F3 Group James_M | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 13 | 23:26:19 | 20260824-2005-B400_B.11-13 | 10 | H1_Night | n04147ed | + | + | - | + | + | + | + | Ref ED-03-129-F3 Group James_M | |
| 5 | 22:51:11 | 20260824-1922-B400_B.11-5 | 14 | H1_C13_HMBC_Night | y52364mw | - | + | - | - | - | + | + | Ref GDB-MJ-360-FULL Group De bo_G | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 5 | 22:35:50 | 20260824-1922-B400_B.11-5 | 13 | H1_C13_HSQC_Night | y52364mw | - | + | - | - | - | + | + | Ref GDB-MJ-360-FULL Group De bo_G | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 5 | 22:22:24 | 20260824-1922-B400_B.11-5 | 12 | H1_COSY_HiRes_Night | y52364mw | - | + | - | - | - | + | + | Ref GDB-MJ-360-FULL Group De bo_G | mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false, mdd: No license available for TOPSPIN 2D NUS processing processing without appropriate license continues with parameters Mdd_CsALG = ist, Mdd_CsVE = false |
| 5 | 21:27:57 | 20260824-1922-B400_B.11-5 | 11 | C13_CPD_Night1024 | y52364mw | - | + | - | - | - | + | + | Ref GDB-MJ-360-FULL Group De bo_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 5 | 21:22:26 | 20260824-1922-B400_B.11-5 | 10 | H1_Night | y52364mw | + | + | - | + | + | + | + | Ref GDB-MJ-360-FULL Group De bo_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 10 | 20:57:22 | 20260824-1725-B400_B.11-10 | 12 | P31_NoCPD_Night | p27065cs | - | + | - | - | - | + | + | Ref CS_31_1 Group Goodwin_C | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 10 | 20:29:40 | 20260824-1725-B400_B.11-10 | 11 | P31_CPD_Night | p27065cs | + | + | - | + | + | + | + | Ref CS_31_1 Group Goodwin_C | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 12 | 20:14:44 | 20260824-1958-B400_B.11-11 | 20 | H1_Night128 | m09677nb | + | + | - | + | x | + | + | Ref cyclopent no2 Group Greaney_M | topshim: TopshimPerformShimming - too many points lost during fit, Shim failed |
| 11 | 19:59:35 | 20260824-1958-B400_B.11-11 | 10 | H1_Night128 | m09677nb | + | + | - | + | + | + | + | Ref 2ph 3me Group Greaney_M | |
| 10 | 19:55:02 | 20260824-1725-B400_B.11-10 | 10 | H1_Night | p27065cs | + | + | - | + | + | + | + | Ref CS_31_1 Group Goodwin_C | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 7 | 19:51:00 | 20260824-1924-B400_B.11-7 | 10 | H1_Night | y52364mw | + | + | - | + | + | + | + | Ref GDB-MJ-D3-heat Group De bo_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 6 | 19:46:12 | 20260824-1923-B400_B.11-6 | 10 | H1_Night | y52364mw | + | + | - | + | + | + | + | Ref GDB-MJ-D3-DMAP-heat Group De bo_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 3 | 19:15:42 | 20260824-1251-B400_B.11-3 | 12 | C13_DEPT135_Night | z88883sp | + | + | - | + | + | + | + | Ref SP408j Group Romanov_A | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 13 | 19:00:49 | 20260824-1819-B400_B.11-13 | 10 | H1_Night128 | f11141tm | + | + | - | + | + | + | + | Ref Cu(Salen)-Mn LiBr 3mA 3h dry by MgSO4 Group Yang_S | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 3 | 18:03:43 | 20260824-1251-B400_B.11-3 | 11 | C13_CPD_Night1024 | z88883sp | + | + | - | + | + | + | + | Ref SP408j Group Romanov_A | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 21 | 17:59:35 | 20260824-1744-B400_B.11-19 | 30 | H1_Day16 | x06125gb | + | + | - | + | + | + | + | Ref GCGB509F68-80 Group Crisenza_G | |
| 20 | 17:53:55 | 20260824-1744-B400_B.11-19 | 20 | H1_Day16 | x06125gb | + | + | - | + | + | + | + | Ref GCGB509F53-54 Group Crisenza_G | |
| 19 | 17:47:45 | 20260824-1744-B400_B.11-19 | 10 | H1_Day16 | x06125gb | + | + | - | + | + | + | + | Ref GCGB509Flu Group Crisenza_G | |
| 18 | 17:33:06 | 20260824-1523-B400_B.11-18 | 10 | H1_Night128 | f11141tm | + | + | - | + | + | + | + | Ref Cu-Mn LiBr 3mA 3h 1mL junsanjiaben with extra cyclohexane-Br Group Yang_S | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 9 | 17:27:57 | 20260824-1646-B400_B.11-9 | 12 | Si29_DEPT90_Day | m69065je | - | + | - | - | - | + | + | Ref JEK699_dec_moreC6D6 Group Mills_D JEK699_dec_moreC6D6 | sref: NUCLEUS '29Si' not defined for SOLVENT 'C6D6' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Mills_D/data/m69065je/nmr/20260824-1646-B400_B.11-9/12/pdata/1/peaks!, sref: NUCLEUS '29Si' not defined for SOLVENT 'C6D6' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Mills_D/data/m69065je/nmr/20260824-1646-B400_B.11-9/12/pdata/1/peaks! |
| 9 | 17:26:16 | 20260824-1646-B400_B.11-9 | 11 | B11_NoCPD_Day | m69065je | - | + | - | - | - | + | + | Ref JEK699_dec_moreC6D6 Group Mills_D JEK699_dec_moreC6D6 | log_err: acqt0 not set in pulse program, result may be incorrect!, log_err: acqt0 not set in pulse program, result may be incorrect!, sref: NUCLEUS '11B' not defined for SOLVENT 'C6D6' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Mills_D/data/m69065je/nmr/20260824-1646-B400_B.11-9/11/pdata/1/peaks!, sref: NUCLEUS '11B' not defined for SOLVENT 'C6D6' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Mills_D/data/m69065je/nmr/20260824-1646-B400_B.11-9/11/pdata/1/peaks! |
| 9 | 17:21:58 | 20260824-1646-B400_B.11-9 | 10 | H1_Day16 | m69065je | + | + | - | + | + | + | + | Ref JEK699_dec_moreC6D6 Group Mills_D JEK699_dec_moreC6D6 | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 8 | 17:16:58 | 20260824-1646-B400_B.11-8 | 12 | Si29_DEPT90_Day | m69065je | - | + | - | - | - | + | + | Ref JEK698_3eq_t1 Group Mills_D JEK698_3eq_t1 | sref: NUCLEUS '29Si' not defined for SOLVENT 'C6D6' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Mills_D/data/m69065je/nmr/20260824-1646-B400_B.11-8/12/pdata/1/peaks!, sref: NUCLEUS '29Si' not defined for SOLVENT 'C6D6' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Mills_D/data/m69065je/nmr/20260824-1646-B400_B.11-8/12/pdata/1/peaks! |
| 8 | 17:15:10 | 20260824-1646-B400_B.11-8 | 11 | B11_NoCPD_Day | m69065je | - | + | - | - | - | + | + | Ref JEK698_3eq_t1 Group Mills_D JEK698_3eq_t1 | log_err: acqt0 not set in pulse program, result may be incorrect!, log_err: acqt0 not set in pulse program, result may be incorrect!, sref: NUCLEUS '11B' not defined for SOLVENT 'C6D6' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Mills_D/data/m69065je/nmr/20260824-1646-B400_B.11-8/11/pdata/1/peaks!, sref: NUCLEUS '11B' not defined for SOLVENT 'C6D6' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Mills_D/data/m69065je/nmr/20260824-1646-B400_B.11-8/11/pdata/1/peaks! |
| 8 | 17:11:13 | 20260824-1646-B400_B.11-8 | 10 | H1_Day16 | m69065je | + | + | - | + | + | + | + | Ref JEK698_3eq_t1 Group Mills_D JEK698_3eq_t1 | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 7 | 17:06:04 | 20260824-1646-B400_B.11-7 | 12 | Si29_DEPT90_Day | m69065je | - | + | - | - | - | + | + | Ref JEK697_3eq_t1 Group Mills_D JEK697_3eq_t1 | sref: NUCLEUS '29Si' not defined for SOLVENT 'C6D6' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Mills_D/data/m69065je/nmr/20260824-1646-B400_B.11-7/12/pdata/1/peaks!, sref: NUCLEUS '29Si' not defined for SOLVENT 'C6D6' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Mills_D/data/m69065je/nmr/20260824-1646-B400_B.11-7/12/pdata/1/peaks! |
| 7 | 17:03:50 | 20260824-1646-B400_B.11-7 | 11 | B11_NoCPD_Day | m69065je | - | + | - | - | - | + | + | Ref JEK697_3eq_t1 Group Mills_D JEK697_3eq_t1 | log_err: acqt0 not set in pulse program, result may be incorrect!, log_err: acqt0 not set in pulse program, result may be incorrect!, sref: NUCLEUS '11B' not defined for SOLVENT 'C6D6' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Mills_D/data/m69065je/nmr/20260824-1646-B400_B.11-7/11/pdata/1/peaks!, sref: NUCLEUS '11B' not defined for SOLVENT 'C6D6' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Mills_D/data/m69065je/nmr/20260824-1646-B400_B.11-7/11/pdata/1/peaks! |
| 7 | 16:59:54 | 20260824-1646-B400_B.11-7 | 10 | H1_Day16 | m69065je | + | + | - | + | + | + | + | Ref JEK697_3eq_t1 Group Mills_D JEK697_3eq_t1 | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 6 | 16:58:29 | 20260824-1643-B400_B.11-6 | 4010132 | P31_NoCPD_Day | w05220ss | - | + | - | - | - | + | + | Ref JA-SiS-IV-01 Group Abbenseth_J JA-SiS-IV-01 P DippN3 -31P | sref: reference peak not found default calibration done; pp: Cannot find any peak for scaling in /mnt/nmrdata/Abbenseth_J/data/w05220ss/nmr/20260824-1643-B400_B.11-6/4010132/pdata/1/peaks!, sref: reference peak not found default calibration done; pp: Cannot find any peak for scaling in /mnt/nmrdata/Abbenseth_J/data/w05220ss/nmr/20260824-1643-B400_B.11-6/4010132/pdata/1/peaks! |
| 6 | 16:56:06 | 20260824-1643-B400_B.11-6 | 4010131 | P31_Wide_Day | w05220ss | - | + | - | - | - | + | + | Ref JA-SiS-IV-01 Group Abbenseth_J JA-SiS-IV-01 P DippN3 -31P{1H} | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 6 | 16:51:50 | 20260824-1643-B400_B.11-6 | 4010101 | H1_Day16 | w05220ss | + | + | - | + | + | + | + | Ref JA-SiS-IV-01 Group Abbenseth_J JA-SiS-IV-01 P DippN3 -1H | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 5 | 16:49:55 | 20260824-1631-B400_B.11-4 | 21 | C13_CPD_Day | e02956op | - | + | - | - | - | + | + | Ref GDB-OP0561B-1H_CDCl3 Group De bo_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 5 | 16:45:09 | 20260824-1631-B400_B.11-4 | 20 | H1_Day | e02956op | + | + | - | + | + | + | + | Ref GDB-OP0561B-1H_CDCl3 Group De bo_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 4 | 16:43:14 | 20260824-1631-B400_B.11-4 | 11 | C13_CPD_Day | e02956op | - | + | - | - | - | + | + | Ref GDB-OP0561A-1H_CDCl3 Group De bo_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 4 | 16:38:27 | 20260824-1631-B400_B.11-4 | 10 | H1_Day | e02956op | + | + | - | + | + | + | + | Ref GDB-OP0561A-1H_CDCl3 Group De bo_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 60 | 16:24:43 | 20260824-1455-B400_B.11-60 | 11 | H1_Night128 | b19299kh | + | + | - | + | + | + | + | Ref STL-XLD-Br2-2nd cycle-drops of THF-crude product Group Liddle_S | |
| 2 | 16:23:10 | 20260824-1615-B400_B.11-2 | 11 | H1_Wide_Day | c37930an | - | + | - | - | - | + | + | Ref STL-AN-057_NBO Group Liddle_S STL-AN-05_NBOH_32mg | |
| 2 | 16:18:50 | 20260824-1615-B400_B.11-2 | 10 | H1_Day16 | c37930an | + | + | - | + | + | + | + | Ref STL-AN-057_NBO Group Liddle_S STL-AN-05_NBOH_32mg | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 60 | 16:01:46 | 20260824-1455-B400_B.11-60 | 10 | C13_CPD_Night256 | b19299kh | + | + | - | + | + | + | + | Ref STL-XLD-Br2-2nd cycle-drops of THF-crude product Group Liddle_S | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 21 | 15:57:29 | 20260824-1534-B400_B.11-21 | 10 | H1_Day16 | mbdxkrn2 | + | + | - | + | + | + | + | Ref GDB-RN1728 2nd Prep Main Band - Acetone-d6 Group De bo_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 20 | 15:53:03 | 20260824-1534-B400_B.11-20 | 10 | H1_Day16 | mbdxkrn2 | + | + | - | + | + | + | + | Ref GDB-RN1621 Prep Mid Band - Acetone-d6 Group De bo_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 19 | 15:48:14 | 20260824-1533-B400_B.11-19 | 10 | H1_Day16 | mbdxkrn2 | + | + | - | + | + | + | + | Ref GDB-RN1729 Et2O-precipitated crude - DMSO-d6 Group De bo_G | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 17 | 15:33:44 | 20260824-1522-B400_B.11-17 | 10 | H1_Night128 | f11141tm | + | + | - | + | + | + | + | Ref Cu-Mn LiBr 3mA 3h 1mL junsanjiaben Group Yang_S | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 16 | 15:33:15 | 20260824-1446-B400_B.11-16 | 10 | H1_Day | j82494jb | - | - | - | - | - | - | - | Ref QBB-G138-2hrs Group Leigh_D | |
| 15 | 15:25:55 | 20260824-1441-B400_B.11-15 | 10 | H1_Day16 | z92209cg | + | + | - | + | + | + | + | Ref gck-011-2408 Group Leigh_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 14 | 15:20:08 | 20260824-1429-B400_B.11-13 | 20 | H1_Day16 | x06125gb | + | + | - | + | + | + | + | Ref GCGB509F90+ Group Crisenza_G | |
| 13 | 15:13:57 | 20260824-1429-B400_B.11-13 | 10 | H1_Day16 | x06125gb | + | + | - | + | + | + | + | Ref GCGB509F93-105 Group Crisenza_G | |
| 12 | 15:07:47 | 20260824-1423-B400_B.11-12 | 11 | 19F_Quant | q62112nk | - | + | - | - | - | + | + | Ref djp-nk-472-tbutyl Group Procter_D | sref: NUCLEUS '19F' not defined for SOLVENT 'DMSO' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'DMSO' SR is set to 0.0 |
| 12 | 14:55:16 | 20260824-1423-B400_B.11-12 | 10 | H1_Quant_D1_25s_Day | q62112nk | + | + | - | + | + | + | + | Ref djp-nk-472-tbutyl Group Procter_D | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 11 | 14:50:38 | 20260824-1422-B400_B.11-11 | 10 | H1_Day16 | q62112nk | + | + | - | + | + | + | + | Ref djp-nk-469 Group Procter_D | |
| 10 | 14:45:19 | 20260824-1417-B400_B.11-10 | 12 | Si29_DEPT90_Day | m69065je | - | + | - | - | - | + | + | Ref JEK699_2eq_htd100_t72 Group Mills_D JEK699_2eq_htd100_t72 | sref: NUCLEUS '29Si' not defined for SOLVENT 'C6D6' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Mills_D/data/m69065je/nmr/20260824-1417-B400_B.11-10/12/pdata/1/peaks!, sref: NUCLEUS '29Si' not defined for SOLVENT 'C6D6' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Mills_D/data/m69065je/nmr/20260824-1417-B400_B.11-10/12/pdata/1/peaks! |
| 10 | 14:43:38 | 20260824-1417-B400_B.11-10 | 11 | B11_NoCPD_Day | m69065je | - | + | - | - | - | + | + | Ref JEK699_2eq_htd100_t72 Group Mills_D JEK699_2eq_htd100_t72 | log_err: acqt0 not set in pulse program, result may be incorrect!, log_err: acqt0 not set in pulse program, result may be incorrect!, sref: NUCLEUS '11B' not defined for SOLVENT 'C6D6' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Mills_D/data/m69065je/nmr/20260824-1417-B400_B.11-10/11/pdata/1/peaks!, sref: NUCLEUS '11B' not defined for SOLVENT 'C6D6' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Mills_D/data/m69065je/nmr/20260824-1417-B400_B.11-10/11/pdata/1/peaks! |
| 10 | 14:39:32 | 20260824-1417-B400_B.11-10 | 10 | H1_Day16 | m69065je | + | + | - | + | + | + | + | Ref JEK699_2eq_htd100_t72 Group Mills_D JEK699_2eq_htd100_t72 | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 9 | 14:34:14 | 20260824-1417-B400_B.11-9 | 12 | Si29_DEPT90_Day | m69065je | - | + | - | - | - | + | + | Ref JEK698_2eq_t72 Group Mills_D JEK698_2eq_t72 | sref: NUCLEUS '29Si' not defined for SOLVENT 'C6D6' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Mills_D/data/m69065je/nmr/20260824-1417-B400_B.11-9/12/pdata/1/peaks!, sref: NUCLEUS '29Si' not defined for SOLVENT 'C6D6' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Mills_D/data/m69065je/nmr/20260824-1417-B400_B.11-9/12/pdata/1/peaks! |
| 9 | 14:32:33 | 20260824-1417-B400_B.11-9 | 11 | B11_NoCPD_Day | m69065je | - | + | - | - | - | + | + | Ref JEK698_2eq_t72 Group Mills_D JEK698_2eq_t72 | log_err: acqt0 not set in pulse program, result may be incorrect!, log_err: acqt0 not set in pulse program, result may be incorrect!, sref: NUCLEUS '11B' not defined for SOLVENT 'C6D6' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Mills_D/data/m69065je/nmr/20260824-1417-B400_B.11-9/11/pdata/1/peaks!, sref: NUCLEUS '11B' not defined for SOLVENT 'C6D6' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Mills_D/data/m69065je/nmr/20260824-1417-B400_B.11-9/11/pdata/1/peaks! |
| 9 | 14:28:29 | 20260824-1417-B400_B.11-9 | 10 | H1_Day16 | m69065je | + | + | - | + | + | + | + | Ref JEK698_2eq_t72 Group Mills_D JEK698_2eq_t72 | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 8 | 14:23:20 | 20260824-1416-B400_B.11-8 | 12 | Si29_DEPT90_Day | m69065je | - | + | - | - | - | + | + | Ref JEK697_2eq_t72 Group Mills_D JEK697_2eq_t72 | sref: NUCLEUS '29Si' not defined for SOLVENT 'C6D6' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Mills_D/data/m69065je/nmr/20260824-1416-B400_B.11-8/12/pdata/1/peaks!, sref: NUCLEUS '29Si' not defined for SOLVENT 'C6D6' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Mills_D/data/m69065je/nmr/20260824-1416-B400_B.11-8/12/pdata/1/peaks! |
| 8 | 14:21:40 | 20260824-1416-B400_B.11-8 | 11 | B11_NoCPD_Day | m69065je | - | + | - | - | - | + | + | Ref JEK697_2eq_t72 Group Mills_D JEK697_2eq_t72 | log_err: acqt0 not set in pulse program, result may be incorrect!, log_err: acqt0 not set in pulse program, result may be incorrect!, sref: NUCLEUS '11B' not defined for SOLVENT 'C6D6' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Mills_D/data/m69065je/nmr/20260824-1416-B400_B.11-8/11/pdata/1/peaks!, sref: NUCLEUS '11B' not defined for SOLVENT 'C6D6' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Mills_D/data/m69065je/nmr/20260824-1416-B400_B.11-8/11/pdata/1/peaks! |
| 8 | 14:17:32 | 20260824-1416-B400_B.11-8 | 10 | H1_Day16 | m69065je | + | + | - | + | + | + | + | Ref JEK697_2eq_t72 Group Mills_D JEK697_2eq_t72 | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 7 | 14:11:30 | 20260824-1400-B400_B.11-7 | 10 | H1_Day16 | j88755sb | + | + | - | + | + | + | + | Ref capg-sb071-B Group Goodwin_C | sref: reference peak not found default calibration done, sref: reference peak not found default calibration done |
| 6 | 14:07:22 | 20260824-1400-B400_B.11-6 | 10 | H1_Day16 | j88755sb | + | + | - | + | + | + | + | Ref capg-sb071-A Group Goodwin_C | |
| 5 | 14:01:29 | 20260824-1353-B400_B.11-5 | 11 | Si29_DEPT90_Day | mbdxrlw2 | - | + | - | - | - | + | + | Ref lw_cisCbCoCp_f19-28 Group Mills_D | sref: NUCLEUS '29Si' not defined for SOLVENT 'C6D6' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Mills_D/data/mbdxrlw2/nmr/20260824-1353-B400_B.11-5/11/pdata/1/peaks!, sref: NUCLEUS '29Si' not defined for SOLVENT 'C6D6' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Mills_D/data/mbdxrlw2/nmr/20260824-1353-B400_B.11-5/11/pdata/1/peaks! |
| 5 | 13:54:18 | 20260824-1353-B400_B.11-5 | 10 | H1_Day16 | mbdxrlw2 | + | + | - | + | + | + | + | Ref lw_cisCbCoCp_f19-28 Group Mills_D | |
| 3 | 12:52:37 | 20260824-1251-B400_B.11-3 | 10 | H1_Day | z88883sp | + | + | - | + | + | + | + | Ref SP408j Group Romanov_A |