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Setup List
Holder Status Name ExpNo Experiment User Time Title
1 Submitted 20250731-1556-B400_B.11-1 10 n H1_Night1024 Proton, ns = 12024, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 Hour 25 min 48 sec y37570lc 01:25:48 Ref lc612-1 polymer E1170 Group DeBo_G
2 Submitted 20250731-1556-B400_B.11-2 10 n H1_Night1024 Proton, ns = 12024, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 Hour 25 min 48 sec y37570lc 01:25:48 Ref lc612-1 MeOH E1170 Group DeBo_G
3 Submitted 20250731-1557-B400_B.11-3 10 n H1_Night1024 Proton, ns = 12024, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 Hour 25 min 48 sec y37570lc 01:25:48 Ref lc612-1 polymer E1171 Group DeBo_G
4 Submitted 20250731-1557-B400_B.11-4 10 n H1_Night1024 Proton, ns = 12024, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 Hour 25 min 48 sec y37570lc 01:25:48 Ref lc612-1 MeOH E1171 Group DeBo_G
5 Submitted 20250801-1513-B400_B.11-5 10 n H1_Night1024 Proton, ns = 12024, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 Hour 25 min 48 sec x25009jo 01:25:48 Ref GDB-JO-851-THF PSNW Group DeBo_G
6 Completed 20250801-1514-B400_B.11-6 10 n H1_Night Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 min 30 sec x25009jo 00:01:30 Ref GDB-JO-858-FC Group DeBo_G
6 Submitted 20250801-1514-B400_B.11-6 11 n C13_CPD_Night1024 Carbon, , ns = 1024, sw = 318 ppm, centre (o1p) = 115 ppm, time = 52 min 51 sec x25009jo 00:52:51 Ref GDB-JO-858-FC Group DeBo_G
6 Submitted 20250801-1514-B400_B.11-6 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 x25009jo 00:34:17 Ref GDB-JO-858-FC Group DeBo_G
6 Submitted 20250801-1514-B400_B.11-6 13 c H1_C13_HSQC_US_Night Proton-Carbon HSQC, ns = 2, sw = auto x 222 ppm, centre (o1p) = auto, 100 ppm, time = 14 min 23 sec x25009jo 00:14:23 Ref GDB-JO-858-FC Group DeBo_G
6 Submitted 20250801-1514-B400_B.11-6 14 c H1_COSY_HiRes_Night COSY, ns = 1, sw = auto, centre (o1p) = auto, time =19 min 20 sec x25009jo 00:12:50 Ref GDB-JO-858-FC Group DeBo_G
7 Submitted 20250731-2230-B400_B.11-7 10 n H1_Night1024 Proton, ns = 12024, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 Hour 25 min 48 sec a74776dr 01:25:48 Ref djp-dr-290-5 Group Procter_D
7 Submitted 20250731-2230-B400_B.11-7 11 n C13_CPD_Night1024 Carbon, , ns = 1024, sw = 318 ppm, centre (o1p) = 115 ppm, time = 52 min 51 sec a74776dr 00:52:51 Ref djp-dr-290-5 Group Procter_D
7 Submitted 20250731-2230-B400_B.11-7 12 n C13_DEPT90_Night DEPT90, proton decoupled, ns = 512, sw = 318 ppm, centre (o1p) = 115 ppm, time = 26 min 21 sec a74776dr 00:26:21 Ref djp-dr-290-5 Group Procter_D
7 Submitted 20250731-2230-B400_B.11-7 13 n C13_DEPT135_Night DEPT135, proton decoupled, ns = 512, sw = 318 ppm, centre (o1p) = 115 ppm, time = 26 min 21 sec a74776dr 00:26:21 Ref djp-dr-290-5 Group Procter_D
7 Submitted 20250731-2230-B400_B.11-7 14 n C13_DEPTQ_Night DEPTQ, proton decoupled, ns = 512, sw = 318 ppm, centre (o1p) = 115 ppm, time = 26 min 23 sec a74776dr 00:26:25 Ref djp-dr-290-5 Group Procter_D
7 Submitted 20250731-2230-B400_B.11-7 15 n H1_Night Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 min 30 sec a74776dr 00:01:30 Ref djp-dr-290-5 Group Procter_D
7 Submitted 20250731-2230-B400_B.11-7 16 c H1_C13_HMBC_US_Night Proton-Carbon HMBC, ns = 4, sw = auto x 222 ppm, centre (o1p) = auto, 100 ppm, time = 33 min 59 sec a74776dr 00:34:00 Ref djp-dr-290-5 Group Procter_D
7 Submitted 20250731-2230-B400_B.11-7 17 c H1_C13_HSQC_US_Night Proton-Carbon HSQC, ns = 2, sw = auto x 222 ppm, centre (o1p) = auto, 100 ppm, time = 14 min 23 sec a74776dr 00:14:23 Ref djp-dr-290-5 Group Procter_D
7 Submitted 20250731-2230-B400_B.11-7 18 c H1_COSY_HiRes_Night COSY, ns = 1, sw = auto, centre (o1p) = auto, time =19 min 20 sec a74776dr 00:12:50 Ref djp-dr-290-5 Group Procter_D
8 Submitted 20250801-1431-B400_B.11-8 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-RN1312 Full Char - DMSO-d6 Group DeBo_G
8 Submitted 20250801-1431-B400_B.11-8 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-RN1312 Full Char - DMSO-d6 Group DeBo_G
8 Submitted 20250801-1431-B400_B.11-8 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-RN1312 Full Char - DMSO-d6 Group DeBo_G
8 Submitted 20250801-1431-B400_B.11-8 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-RN1312 Full Char - DMSO-d6 Group DeBo_G
8 Submitted 20250801-1431-B400_B.11-8 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-RN1312 Full Char - DMSO-d6 Group DeBo_G
8 Submitted 20250801-1431-B400_B.11-8 15 c H1_NOESY_Night NOESY, ns = 4, sw = auto, centre (o1p) = auto, time =12 min 1 sec mbdxkrn2 00:12:04 Ref GDB-RN1312 Full Char - DMSO-d6 Group DeBo_G
15 Submitted 20250801-1432-B400_B.11-15 10 n C13_CPD_Night1024 Carbon, , ns = 1024, sw = 318 ppm, centre (o1p) = 115 ppm, time = 52 min 51 sec mbdxkrn2 01:45:31 Ref GDB-RN1314 Full Char - DMSO-d6 Group DeBo_G
15 Submitted 20250801-1432-B400_B.11-15 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-RN1314 Full Char - DMSO-d6 Group DeBo_G
15 Submitted 20250801-1432-B400_B.11-15 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-RN1314 Full Char - DMSO-d6 Group DeBo_G
15 Submitted 20250801-1432-B400_B.11-15 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-RN1314 Full Char - DMSO-d6 Group DeBo_G
15 Submitted 20250801-1432-B400_B.11-15 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-RN1314 Full Char - DMSO-d6 Group DeBo_G
15 Submitted 20250801-1432-B400_B.11-15 15 c H1_NOESY_Night NOESY, ns = 4, sw = auto, centre (o1p) = auto, time =12 min 1 sec mbdxkrn2 00:12:04 Ref GDB-RN1314 Full Char - DMSO-d6 Group DeBo_G
19 Completed 20250801-1457-B400_B.11-19 10 N H1_ExtraWide_Day Proton, ns = 16, sw = 400 ppm, centre (o1p) = -5 ppm, time = 1 min 21 sec b50715cd 00:00:16 Ref CD202 Group Goodwin_C CD202 - oDFB - 1H
20 Submitted 20250801-1458-B400_B.11-20 11 n C13_CPD_Night256 Carbon, , ns = 256, sw = 318 ppm, centre (o1p) = 115 ppm, time = 13 min 22 sec mbdxkrn2 00:26:32 Ref sd008-endo Group DeBo_G
20 Submitted 20250801-1458-B400_B.11-20 12 n H1_Night Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 min 30 sec mbdxkrn2 00:01:30 Ref sd008-endo Group DeBo_G
20 Submitted 20250801-1458-B400_B.11-20 13 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 sd008-endo Group DeBo_G
20 Submitted 20250801-1458-B400_B.11-20 14 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 sd008-endo Group DeBo_G
20 Submitted 20250801-1458-B400_B.11-20 15 c H1_COSY_HiRes_Night COSY, ns = 1, sw = auto, centre (o1p) = auto, time =19 min 20 sec mbdxkrn2 00:12:50 Ref sd008-endo Group DeBo_G
20 Submitted 20250801-1458-B400_B.11-20 16 c H1_NOESY_Night NOESY, ns = 4, sw = auto, centre (o1p) = auto, time =12 min 1 sec mbdxkrn2 00:12:04 Ref sd008-endo Group DeBo_G
21 Submitted 20250801-1500-B400_B.11-21 11 n C13_CPD_Night256 Carbon, , ns = 256, sw = 318 ppm, centre (o1p) = 115 ppm, time = 13 min 22 sec mbdxkrn2 00:26:32 Ref sd008-exo Group DeBo_G
21 Submitted 20250801-1500-B400_B.11-21 12 n H1_Night Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 min 30 sec mbdxkrn2 00:01:30 Ref sd008-exo Group DeBo_G
21 Submitted 20250801-1500-B400_B.11-21 13 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 sd008-exo Group DeBo_G
21 Submitted 20250801-1500-B400_B.11-21 14 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 sd008-exo Group DeBo_G
21 Submitted 20250801-1500-B400_B.11-21 15 c H1_COSY_HiRes_Night COSY, ns = 1, sw = auto, centre (o1p) = auto, time =19 min 20 sec mbdxkrn2 00:12:50 Ref sd008-exo Group DeBo_G
21 Submitted 20250801-1500-B400_B.11-21 16 c H1_NOESY_Night NOESY, ns = 4, sw = auto, centre (o1p) = auto, time =12 min 1 sec mbdxkrn2 00:12:04 Ref sd008-exo Group DeBo_G
22 Completed 20250801-1502-B400_B.11-22 10 N H1_Day Proton, ns = 4, sw = 20 ppm, centre (o1p) = 6 ppm, time = 30 sec u67812sg 00:00:30 Ref sq-01-137-2 Group Procter_D
22 Completed 20250801-1502-B400_B.11-22 11 N C13_CPD_Day Carbon, proton decoupled, ns = 64, sw = 318 ppm, centre (o1p) = 115 ppm, time = 3 min 29 sec u67812sg 00:01:01 Ref sq-01-137-2 Group Procter_D
23 Completed 20250801-1517-B400_B.11-23 10 N H1_Day16 Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 min 30 sec p00481wi 00:10:52 Ref GDB-WI926-crude-re-NMR-cd3cn Group DeBo_G
23 Completed 20250801-1517-B400_B.11-23 12 c H1_COSY_HiRes_Night COSY, ns = 1, sw = auto, centre (o1p) = auto, time =19 min 20 sec p00481wi 00:12:50 Ref GDB-WI926-crude-re-NMR-cd3cn Group DeBo_G
24 Submitted 20250801-1517-B400_B.11-24 10 n H1_Night1024 Proton, ns = 12024, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 Hour 25 min 48 sec p00481wi 01:25:48 Ref GDB-WI986-polymer-after-Et2O-wash Group DeBo_G
24 Submitted 20250801-1517-B400_B.11-24 11 c H1_COSY_HiRes_Night COSY, ns = 1, sw = auto, centre (o1p) = auto, time =19 min 20 sec p00481wi 00:12:50 Ref GDB-WI986-polymer-after-Et2O-wash Group DeBo_G
25 Submitted 20250801-1517-B400_B.11-25 10 n H1_Night1024 Proton, ns = 12024, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 Hour 25 min 48 sec p00481wi 01:25:48 Ref GDB-WI893-polymer-after-Et2O-wash Group DeBo_G
25 Submitted 20250801-1517-B400_B.11-25 11 c H1_COSY_HiRes_Night COSY, ns = 1, sw = auto, centre (o1p) = auto, time =19 min 20 sec p00481wi 00:12:50 Ref GDB-WI893-polymer-after-Et2O-wash Group DeBo_G
26 Submitted 20250801-0930-B400_B.11-26 11 n C13_CPD_Night1024 Carbon, , ns = 1024, sw = 318 ppm, centre (o1p) = 115 ppm, time = 52 min 51 sec z88883sp 00:52:51 Ref SP365a Group Romanov_A Deprotected, precipitated
26 Submitted 20250801-0930-B400_B.11-26 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 z88883sp 00:34:17 Ref SP365a Group Romanov_A Deprotected, precipitated
26 Submitted 20250801-0930-B400_B.11-26 15 n C13_DEPT135_Night DEPT135, proton decoupled, ns = 512, sw = 318 ppm, centre (o1p) = 115 ppm, time = 26 min 21 sec z88883sp 00:26:21 Ref SP365a Group Romanov_A Deprotected, precipitated
27 Submitted 20250801-1517-B400_B.11-27 10 n H1_Night1024 Proton, ns = 12024, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 Hour 25 min 48 sec p00481wi 01:25:48 Ref GDB-WI975-polymer-after-Et2O-wash Group DeBo_G
27 Submitted 20250801-1517-B400_B.11-27 11 c H1_COSY_HiRes_Night COSY, ns = 1, sw = auto, centre (o1p) = auto, time =19 min 20 sec p00481wi 00:12:50 Ref GDB-WI975-polymer-after-Et2O-wash Group DeBo_G
28 Completed 20250801-1651-B400_B.11-28 10 N H1_Day Proton, ns = 4, sw = 20 ppm, centre (o1p) = 6 ppm, time = 30 sec mbdxrbj2 00:00:30 Ref BJ555_FC Group Procter_D
28 Submitted 20250801-1651-B400_B.11-28 11 n C13_CPD_Night1024 Carbon, , ns = 1024, sw = 318 ppm, centre (o1p) = 115 ppm, time = 52 min 51 sec mbdxrbj2 00:52:51 Ref BJ555_FC Group Procter_D
28 Submitted 20250801-1651-B400_B.11-28 12 n H1_Night Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 min 30 sec mbdxrbj2 00:01:30 Ref BJ555_FC Group Procter_D
28 Submitted 20250801-1651-B400_B.11-28 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 mbdxrbj2 00:14:29 Ref BJ555_FC Group Procter_D
29 Submitted 20250801-1020-B400_B.11-29 10 n H1_Night1024 Proton, ns = 12024, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 Hour 25 min 48 sec x25009jo 01:25:48 Ref GDB-JO-851-PSNW Group DeBo_G
30 Submitted 20250801-1020-B400_B.11-30 10 n H1_Night1024 Proton, ns = 12024, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 Hour 25 min 48 sec x25009jo 01:25:48 Ref GDB-JO-864-K3_P Group DeBo_G
31 Submitted 20250801-1020-B400_B.11-31 10 n H1_Night1024 Proton, ns = 12024, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 Hour 25 min 48 sec x25009jo 01:25:48 Ref GDB-KJO-864-K3-M Group DeBo_G
32 Completed 20250801-1558-B400_B.11-32 10 N H1_Day16 Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 min 30 sec j83970qc 00:01:30 Ref qc e606 c Group DeBo_G
33 Completed 20250801-1558-B400_B.11-33 10 N H1_Day Proton, ns = 4, sw = 20 ppm, centre (o1p) = 6 ppm, time = 30 sec n51547cb 00:01:10 Ref 1H Zr=PH Rb After beamline Group Liddle_S
33 Completed 20250801-1558-B400_B.11-33 11 N P31_CPD_Day Phosphorus, proton decoupled, ns = 16, sw = 245 ppm, centre (o1p) = 0 ppm, time = 52 sec n51547cb 00:06:15 Ref 31P Zr=PH Rb After beamline Group Liddle_S
34 Completed 20250801-1559-B400_B.11-34 10 N H1_Day Proton, ns = 4, sw = 20 ppm, centre (o1p) = 6 ppm, time = 30 sec n51547cb 00:00:30 Ref 1H TiCl Group Liddle_S
34 Submitted 20250801-1559-B400_B.11-34 11 N C13_CPD_Day Carbon, proton decoupled, ns = 64, sw = 318 ppm, centre (o1p) = 115 ppm, time = 3 min 29 sec n51547cb 00:52:51 Ref 13C TiCl Group Liddle_S
34 Submitted 20250801-1559-B400_B.11-34 12 N Si29_DEPT90_Day Silicon DEPT90, proton decoupled, ns = 32, sw = 403 ppm, centre (o1p) = 0 ppm, time = 1 min 51 sec n51547cb 00:52:20 Ref 29Si TiCl Group Liddle_S
35 Completed 20250801-1620-B400_B.11-35 10 N H1_Day Proton, ns = 4, sw = 20 ppm, centre (o1p) = 6 ppm, time = 30 sec b36621hr 00:00:30 Ref DPM-HR194-MeOH+As''' (Cat HCl) Group Mills_D
35 Completed 20250801-1620-B400_B.11-35 11 N C13_CPD_Day Carbon, proton decoupled, ns = 64, sw = 318 ppm, centre (o1p) = 115 ppm, time = 3 min 29 sec b36621hr 00:01:01 Ref DPM-HR194-MeOH+As''' (Cat HCl) Group Mills_D
35 Completed 20250801-1620-B400_B.11-35 12 N Si29_DEPT90_Day Silicon DEPT90, proton decoupled, ns = 32, sw = 403 ppm, centre (o1p) = 0 ppm, time = 1 min 51 sec b36621hr 00:03:39 Ref DPM-HR194-MeOH+As''' (Cat HCl) Group Mills_D
36 Completed 20250801-1636-B400_B.11-36 10 N H1_Day16 Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 min 30 sec g16660ml 00:01:30 Ref djp-muxe Group Procter_D
38 Submitted 20250801-1654-B400_B.11-38 10 n H1_WaterSupp_Night y59240mb 00:31:16 Ref 100 microlit P5 x 7.5 BAC dialysis water Group McDonald_T 100 microlit P5 x 7.5 BAC dialysis water
39 Completed 20250801-1707-B400_B.11-39 10 n H1_Quant_Night Proton Quantitative, ns = 16, sw = 20 ppm, centre (o1p) = 6 ppm, time = 5 min 42 sec h91839em 00:05:42 Ref gc em 74 Group Crisenza_G
39 Submitted 20250801-1707-B400_B.11-39 11 n C13_CPD_Night1024 Carbon, , ns = 1024, sw = 318 ppm, centre (o1p) = 115 ppm, time = 52 min 51 sec h91839em 00:52:51 Ref gc em 74 Group Crisenza_G
40 Running 20250801-1710-B400_B.11-40 10 n H1_Night Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 min 30 sec m90460ad 00:01:30 Ref mfg-ad-428 Group Greaney_M
41 Submitted 20250801-1710-B400_B.11-41 10 n H1_Night Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 min 30 sec m90460ad 00:01:30 Ref mfg-ad-425a Group Greaney_M
42 Submitted 20250801-1711-B400_B.11-42 10 n H1_Night Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 min 30 sec m90460ad 00:01:30 Ref mfg-ad-426a Group Greaney_M
43 Submitted 20250801-1713-B400_B.11-43 10 N H1_Day Proton, ns = 4, sw = 20 ppm, centre (o1p) = 6 ppm, time = 30 sec b32507dt 00:00:30 Ref dtg32a Group Webb_S
44 Submitted 20250801-1713-B400_B.11-44 10 N H1_Day Proton, ns = 4, sw = 20 ppm, centre (o1p) = 6 ppm, time = 30 sec b32507dt 00:00:30 Ref dtg32b Group Webb_S
44 Submitted 20250801-1713-B400_B.11-44 11 C H1_COSY_Day COSY, ns = 1, sw = auto, centre (o1p) = auto, time = 2 min 2 sec b32507dt 00:05:11 Ref dtg32b Group Webb_S
44 Submitted 20250801-1713-B400_B.11-44 12 n C13_CPD_Night1024 Carbon, , ns = 1024, sw = 318 ppm, centre (o1p) = 115 ppm, time = 52 min 51 sec b32507dt 00:52:51 Ref dtg32b Group Webb_S
44 Submitted 20250801-1713-B400_B.11-44 13 n H1_Night Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 min 30 sec b32507dt 00:01:30 Ref dtg32b Group Webb_S
44 Submitted 20250801-1713-B400_B.11-44 14 c H1_C13_HMBC_US_Night Proton-Carbon HMBC, ns = 4, sw = auto x 222 ppm, centre (o1p) = auto, 100 ppm, time = 33 min 59 sec b32507dt 00:34:00 Ref dtg32b Group Webb_S
44 Submitted 20250801-1713-B400_B.11-44 15 c H1_C13_HSQC_US_Night Proton-Carbon HSQC, ns = 2, sw = auto x 222 ppm, centre (o1p) = auto, 100 ppm, time = 14 min 23 sec b32507dt 00:14:23 Ref dtg32b Group Webb_S
51 Submitted 20250731-1437-B400_B.11-51 12 c H1_COSY_NS64_Night COSY, ns = 64, sw = auto, centre (o1p) = auto, time =30 min 32 sec y52364mw 02:35:23 Ref GDB-HW-10-FULL Group DeBo_G
51 Submitted 20250731-1437-B400_B.11-51 13 c H1_C13_HSQC_US_Night Proton-Carbon HSQC, ns = 2, sw = auto x 222 ppm, centre (o1p) = auto, 100 ppm, time = 14 min 23 sec y52364mw 00:14:23 Ref GDB-HW-10-FULL Group DeBo_G
51 Submitted 20250731-1437-B400_B.11-51 14 c H1_C13_HMBC_US_Night Proton-Carbon HMBC, ns = 4, sw = auto x 222 ppm, centre (o1p) = auto, 100 ppm, time = 33 min 59 sec y52364mw 00:34:00 Ref GDB-HW-10-FULL Group DeBo_G
History List
Holder Time Name ExpNo Experiment User Load Atma Spin Lock Shim Acq Proc Title Remarks
40 17:58:34 20250801-1710-B400_B.11-40 10 H1_Night m90460ad - - - - - - - Ref mfg-ad-428 Group Greaney_M
39 17:10:05 20250801-1707-B400_B.11-39 10 H1_Quant_Night h91839em + + - + x + - Ref gc em 74 Group Crisenza_G Shim failed, Automation was stopped by user
28 17:05:46 20250801-1651-B400_B.11-28 10 H1_Day mbdxrbj2 + + - + + + + Ref BJ555_FC Group Procter_D sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
23 16:49:41 20250801-1517-B400_B.11-23 12 H1_COSY_HiRes_Night p00481wi + + - + + + + Ref GDB-WI926-crude-re-NMR-cd3cn Group DeBo_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 16:42:36 20250801-1514-B400_B.11-6 10 H1_Night x25009jo + + - + + + + Ref GDB-JO-858-FC Group DeBo_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
36 16:37:54 20250801-1636-B400_B.11-36 10 H1_Day16 g16660ml + + - + + + + Ref djp-muxe Group Procter_D sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
35 16:32:28 20250801-1620-B400_B.11-35 12 Si29_DEPT90_Day b36621hr - + - - - + + Ref DPM-HR194-MeOH+As''' (Cat HCl) 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/b36621hr/nmr/20250801-1620-B400_B.11-35/12/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/b36621hr/nmr/20250801-1620-B400_B.11-35/12/pdata/1/peaks!
35 16:29:50 20250801-1620-B400_B.11-35 11 C13_CPD_Day b36621hr - + - - - + + Ref DPM-HR194-MeOH+As''' (Cat HCl) Group Mills_D
35 16:26:42 20250801-1620-B400_B.11-35 10 H1_Day b36621hr + + - + + + + Ref DPM-HR194-MeOH+As''' (Cat HCl) Group Mills_D
34 16:23:35 20250801-1559-B400_B.11-34 10 H1_Day n51547cb + + - + + + + Ref 1H TiCl Group Liddle_S
33 16:15:35 20250801-1558-B400_B.11-33 11 P31_CPD_Day n51547cb - + - - - + + Ref 31P Zr=PH Rb After beamline Group Liddle_S sref: reference peak outside file limits default calibration done; pp: Cannot find any peak for scaling in /mnt/nmrdata/Liddle_S/data/n51547cb/nmr/20250801-1558-B400_B.11-33/11/pdata/1/peaks!, sref: reference peak outside file limits default calibration done; pp: Cannot find any peak for scaling in /mnt/nmrdata/Liddle_S/data/n51547cb/nmr/20250801-1558-B400_B.11-33/11/pdata/1/peaks!
33 16:11:01 20250801-1558-B400_B.11-33 10 H1_Day n51547cb + + - + + + + Ref 1H Zr=PH Rb After beamline Group Liddle_S
32 16:06:45 20250801-1558-B400_B.11-32 10 H1_Day16 j83970qc + + - + + + + Ref qc e606 c Group DeBo_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
28 16:02:12 20250801-1557-B400_B.11-28 10 H1_Day16 j83970qc + + - + + + + Ref qc e606 r1 Group DeBo_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
23 15:48:12 20250801-1517-B400_B.11-23 10 H1_Day16 p00481wi + + - + + + + Ref GDB-WI926-crude-re-NMR-cd3cn Group DeBo_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
22 15:46:17 20250801-1502-B400_B.11-22 11 C13_CPD_Day u67812sg - + - - - + + Ref sq-01-137-2 Group Procter_D sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
22 15:42:36 20250801-1502-B400_B.11-22 10 H1_Day u67812sg + + - + + + + Ref sq-01-137-2 Group Procter_D sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
19 15:40:23 20250801-1457-B400_B.11-19 10 H1_ExtraWide_Day b50715cd + + - + + + + Ref CD202 Group Goodwin_C CD202 - oDFB - 1H pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Goodwin_C/data/b50715cd/nmr/20250801-1457-B400_B.11-19/10/pdata/1/peaks!, pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Goodwin_C/data/b50715cd/nmr/20250801-1457-B400_B.11-19/10/pdata/1/peaks!
18 15:38:28 20250801-1456-B400_B.11-18 11 C13_CPD_Day m90460ad - + - - - + + Ref mfg-ad-429b Group Greaney_M sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
18 15:33:28 20250801-1456-B400_B.11-18 10 H1_Day m90460ad + + - + + + + Ref mfg-ad-429b Group Greaney_M
17 15:31:28 20250801-1455-B400_B.11-17 11 C13_CPD_Day m90460ad - + - - - + + Ref mfg-ad-429a Group Greaney_M sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
17 15:26:32 20250801-1455-B400_B.11-17 10 H1_Day m90460ad + + - + + + + Ref mfg-ad-429a Group Greaney_M
16 15:19:11 20250801-1439-B400_B.11-16 10 H1_Day16 h91839em + + - + + + + Ref GC em 74C Group Crisenza_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
14 15:15:58 20250801-1435-B400_B.11-14 10 H1_Day m52750pm + + - + + + + Ref GCPM99F2 Group Crisenza_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
13 15:11:29 20250801-1345-B400_B.11-13 10 H1_Day c62220rg + + - + + + + Ref at-rg-4-66 6h Group Trowbridge_A sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
12 15:06:42 20250801-1345-B400_B.11-12 10 H1_Day c62220rg + + - + + + + Ref at-rg-4-65 6 h Group Trowbridge_A sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
11 15:02:08 20250801-1345-B400_B.11-11 10 H1_Day c62220rg + + - + + + + Ref at-rg-4-64 6h Group Trowbridge_A sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
9 14:56:10 20250801-1439-B400_B.11-9 10 H1_Day16 h91839em + + - + + + + Ref gc em 73 C Group Crisenza_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
6 14:54:02 20250801-1422-B400_B.11-6 12 F19_NoCPD_Day q85514th - + - - - + + Ref 1004DI-P Group Greaney_M 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 14:52:07 20250801-1422-B400_B.11-6 11 C13_CPD_Day q85514th - + - - - + + Ref 1004DI-P Group Greaney_M sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
6 14:48:04 20250801-1422-B400_B.11-6 10 H1_Day q85514th + + - + + + + Ref 1004DI-P Group Greaney_M
5 14:46:09 20250801-1422-B400_B.11-5 11 C13_CPD_Day q85514th - + - - - + + Ref 505DI-P Group Greaney_M sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
5 14:41:39 20250801-1422-B400_B.11-5 10 H1_Day q85514th + + - + + + + Ref 505DI-P Group Greaney_M
60 14:36:27 20250801-1256-B400_B.11-60 10 H1_Day16 y52364mw + + - + + + + Ref GDB-MJ-131-t6-vial2 Group DeBo_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
58 14:31:25 20250801-1220-B400_B.11-58 10 H1_Day16 h55599rb + + - + + + + Ref RB-9-562 Group Procter_D
57 14:26:23 20250801-1220-B400_B.11-57 10 H1_Day16 h55599rb + + - + + + + Ref RB-9-561 Group Procter_D
56 14:21:19 20250801-1220-B400_B.11-56 10 H1_Day16 h55599rb + + - + + + + Ref RB-9-560 Group Procter_D
55 14:15:33 20250801-1256-B400_B.11-55 10 H1_Day16 y52364mw + + - + + + + Ref GDB-MJ-131-t6-vial1 Group DeBo_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
54 14:10:15 20250801-1255-B400_B.11-54 10 H1_Day16 y52364mw + + - + + + + Ref GDB-MJ-137-huiguo Group DeBo_G
53 14:06:09 20250801-1242-B400_B.11-53 10 H1_Day x06125gb + + - + + + + Ref GCGB25601Cr Group Crisenza_G
52 13:59:47 20250801-1217-B400_B.11-52 10 H1_Day16 h55599rb + + - + + + + Ref RB-9-559 Group Procter_D
50 13:52:03 20250801-1216-B400_B.11-50 10 H1_Day16 h55599rb + + - + + + + Ref RB-9-557D Group Procter_D
49 13:46:39 20250801-1213-B400_B.11-49 10 H1_Day16 h91839em + + - + + + + Ref GC EM 74 C Group Crisenza_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
48 13:38:52 20250801-1212-B400_B.11-48 10 H1_Day16 h91839em + + - + + + + Ref GC EM 73 C Group Crisenza_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
9 13:35:20 20250801-1326-B400_B.11-9 10 H1_Day q80578pk + + - + + + + Ref MJJ-PK-01-1105016 Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
8 13:31:12 20250801-1300-B400_B.11-8 10 H1_Day q85514th + + - + + + + Ref 2604DI F9-10 Group Greaney_M
6 13:28:38 20250801-1300-B400_B.11-6 11 C13_CPD_Day q85514th - + - - - + + Ref 2604DI Group Greaney_M sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
6 13:24:26 20250801-1300-B400_B.11-6 10 H1_Day q85514th + + - + + + + Ref 2604DI Group Greaney_M
47 13:18:35 20250801-1203-B400_B.11-47 11 H1_COSY_Day z40973rs - + - - - + + Ref gdb-rs-110 crude Group DeBo_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
47 13:12:38 20250801-1203-B400_B.11-47 10 H1_Day16 z40973rs + + - + + + + Ref gdb-rs-110 crude Group DeBo_G
5 13:08:48 20250801-1257-B400_B.11-5 10 H1_Day p10556ha + + - + + + + Ref HA81 cp Group Keerthi_A sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
46 13:02:56 20250801-1203-B400_B.11-46 11 H1_COSY_Day z40973rs - + - - - + + Ref gdb-rs-109 crude Group DeBo_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
46 12:57:46 20250801-1203-B400_B.11-46 10 H1_Day16 z40973rs + + - + + + + Ref gdb-rs-109 crude Group DeBo_G
45 12:52:59 20250801-1154-B400_B.11-45 10 H1_Day m90460ad + + - + x + + Ref mfg-ad-428 Group Greaney_M topshim: TopshimPerformShimming - too many points lost during fit, Shim failed
44 12:47:18 20250731-1745-B400_B.11-44 13 H1_Day16 h55599rb + + - + + + + Ref RB-9-557A Group Procter_D
43 12:44:10 20250801-1149-B400_B.11-43 11 P31_Wide_Day b36621hr - + - - - + + Ref DPM-HR193-YCl3+3NaPtt 40C o/n Group Mills_D sref: reference peak outside file limits default calibration done, sref: reference peak outside file limits default calibration done
43 12:41:03 20250801-1149-B400_B.11-43 10 H1_Day b36621hr + + - + + + + Ref DPM-HR193-YCl3+3NaPtt 40C o/n Group Mills_D
42 12:35:36 20250801-1147-B400_B.11-42 12 Si29_DEPT90_Day b36621hr - + - - - + + Ref DPM-HR194-As''' + MeOH heated at 40 C o/n 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/b36621hr/nmr/20250801-1147-B400_B.11-42/12/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/b36621hr/nmr/20250801-1147-B400_B.11-42/12/pdata/1/peaks!
42 12:33:41 20250801-1147-B400_B.11-42 11 C13_CPD_Day b36621hr - + - - - + + Ref DPM-HR194-As''' + MeOH heated at 40 C o/n Group Mills_D
42 12:30:33 20250801-1147-B400_B.11-42 10 H1_Day b36621hr + + - + + + + Ref DPM-HR194-As''' + MeOH heated at 40 C o/n Group Mills_D
41 12:26:49 20250801-1141-B400_B.11-41 10 H1_Day m52750pm + + - + + + + Ref GCPM99F1 Group Crisenza_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
40 12:23:45 20250801-1124-B400_B.11-40 10 H1_Day q80578pk + + - + + + + Ref MJJ-PK-01-1104016-D Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
39 12:20:41 20250801-1124-B400_B.11-39 10 H1_Day q80578pk + + - + + + + Ref MJJ-PK-01-1103016-neat Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
38 12:17:04 20250801-1124-B400_B.11-38 10 H1_Day q80578pk + + - + + + + Ref MJJ-PK-01-1103016-T Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
37 12:12:50 20250731-1738-B400_B.11-36 21 H1_Day c62220rg + + - + + + + Ref at-rg-4-66 5 h Group Trowbridge_A sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
36 12:07:54 20250801-1137-B400_B.11-36 10 H1_Day c62220rg + + - + + + + Ref at-rg-4-65 5 h Group Trowbridge_A sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
35 12:01:55 20250801-1138-B400_B.11-35 10 H1_Day c62220rg + + - + + + + Ref at-rg-4-64 5 h Group Trowbridge_A sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
34 11:58:42 20250801-1121-B400_B.11-34 10 H1_Day q80578pk + + - + + + + Ref MJJ-PK-01-115016-neat Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
33 11:55:32 20250801-1117-B400_B.11-33 10 H1_Day q80578pk + + - + + + + Ref MJJ-PK-01-1105016-D-2M Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
32 11:52:00 20250801-1117-B400_B.11-32 10 H1_Day q80578pk + + - + + + + Ref MJJ-PK-01-008-MeCN-New Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
28 11:47:32 20250801-1136-B400_B.11-28 10 H1_Day n31353oc + + - + + + + Ref djp-ov-774 Group Procter_D
27 11:42:07 20250801-1126-B400_B.11-27 10 H1_Day16 f85241bm + + - + + + + Ref BM941-3 Group Bures_J
25 11:39:05 20250801-1116-B400_B.11-25 10 H1_Day q80578pk + + - + + + + Ref MJJ-PK-01-008-14-diox Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
24 11:36:02 20250801-1116-B400_B.11-24 10 H1_Day q80578pk + + - + + + + Ref MJJ-PK-01-008-Py Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
23 11:32:24 20250801-1116-B400_B.11-23 10 H1_Day q80578pk + + - + + + + Ref MJJ-PK-01-008-THF Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
22 11:28:12 20250801-1106-B400_B.11-22 10 H1_Day c62220rg + + - + + + + Ref at-rg-4-66 4h Group Trowbridge_A sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
21 11:23:22 20250801-1106-B400_B.11-21 10 H1_Day c62220rg + + - + + + + Ref at-rg-4-65 4h Group Trowbridge_A sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
20 11:17:53 20250801-1106-B400_B.11-20 10 H1_Day c62220rg + + - + + + + Ref at-rg-4-64 4h Group Trowbridge_A sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
19 11:12:28 20250801-1105-B400_B.11-19 10 H1_Day16 z40241jm + + - + + + + Ref DJP-JIM-7-048-2a Group Procter_D
18 11:07:13 20250801-1105-B400_B.11-18 10 H1_Day16 z40241jm + + - + + + + Ref DJP-JIM-7-049-1a-spot1 Group Procter_D
17 11:02:03 20250801-1059-B400_B.11-17 10 H1_Day h68355ac + + - + + + + Ref MFG-AC-597-(a)-col Group Greaney_M sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
16 10:53:35 20250801-1042-B400_B.11-16 10 H1_Day16 mbdxkrn2 + + - + + + + Ref GDB-RN1550(ii) Prep Main Band - Acetone-d6 Group DeBo_G
15 10:43:57 20250801-1041-B400_B.11-15 10 H1_Day16 mbdxkrn2 + + - + + + + Ref GDB-RN1314 Column Vial 8 - DMSO-d6 Group DeBo_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
14 10:39:31 20250801-1034-B400_B.11-14 10 H1_Day16 y52364mw + + - + + + + Ref GDB-HW-12 Group DeBo_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
13 10:35:16 20250801-1034-B400_B.11-13 10 H1_Day16 y52364mw + + - + + + + Ref GDB-HW-11 Group DeBo_G
28 10:26:43 20250801-1020-B400_B.11-28 10 H1_Day16 x25009jo + + - + + + + Ref GDB-JO-801-MeCN Group DeBo_G
27 10:23:18 20250801-1014-B400_B.11-27 10 H1_Day m52750pm + + - + + + + Ref GCPM101cru Group Crisenza_G
26 10:04:52 20250801-0930-B400_B.11-26 13 H1_C13_HSQC_Night z88883sp + + - + + + + Ref SP365a Group Romanov_A Deprotected, precipitated 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 10:03:39 20250801-0947-B400_B.11-27 11 H1_Day n31353oc - + - - - + + Ref djp-oc-775-is-b Group Procter_D sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
27 09:50:49 20250801-0947-B400_B.11-27 10 H1_Quant_D1_25s_Day n31353oc + + - + + + + Ref djp-oc-775-is-b Group Procter_D sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
26 09:37:20 20250801-0930-B400_B.11-26 12 H1_COSY_HiRes_Night z88883sp - + - - - + + Ref SP365a Group Romanov_A Deprotected, precipitated 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
26 09:32:37 20250801-0930-B400_B.11-26 10 H1_Night z88883sp + + - + + + + Ref SP365a Group Romanov_A Deprotected, precipitated
49 09:27:49 20250801-0926-B400_B.11-49 10 H1_Day a15978el + + - + + + + Ref EL-03-208-c Group James_M sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
56 09:17:28 20250801-0858-B400_B.11-56 10 H1_Day c62220rg + + - + + + + Ref at-rg-4-66- o.n Group Trowbridge_A sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
55 09:12:37 20250801-0858-B400_B.11-55 10 H1_Day c62220rg + + - + + + + Ref at-rg-4-65 o.n Group Trowbridge_A sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
54 09:07:27 20250801-0858-B400_B.11-54 10 H1_Day c62220rg + + - + + + + Ref at-rg-4-64 o.n Group Trowbridge_A sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
53 09:02:12 20250801-0856-B400_B.11-53 10 H1_Day16 h55599rb + + - + + + + Ref RB-9-557C Group Procter_D
52 08:57:03 20250801-0856-B400_B.11-52 10 H1_Day16 h55599rb + + - + + + + Ref RB-9-557B Group Procter_D
45 08:45:49 20250731-1801-B400_B.11-45 11 C13_CPD_Day g16660ml - + - - - + + Ref djp-muze-alkyne-i Group Procter_D
45 08:41:42 20250731-1801-B400_B.11-45 10 H1_Day g16660ml + + - + + + + Ref djp-muze-alkyne-i Group Procter_D sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
19 08:36:21 20250731-1709-B400_B.11-19 10 H1_Day n31353oc + + - + + + + Ref djp-oc-774-crude Group Procter_D
18 08:31:33 20250731-1700-B400_B.11-18 10 H1_Day16 r57145lg + + - + + + + Ref capg_LPG_PGT001-2_after_plug Group Goodwin_C
21 08:26:24 20250731-1634-B400_B.11-21 10 H1_Day b32507dt + + - + + + + Ref dt 157 8 Group Webb_S
20 08:20:54 20250731-1634-B400_B.11-20 10 H1_Day b32507dt + + - + + + + Ref 157 10 13 Group Webb_S
17 08:14:38 20250731-1633-B400_B.11-17 10 H1_Day b32507dt + + - + + + + Ref dt157 x Group Webb_S
51 07:20:53 20250731-1437-B400_B.11-51 11 C13_CPD_Night1024 y52364mw - + - - - + + Ref GDB-HW-10-FULL Group DeBo_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
51 07:16:43 20250731-1437-B400_B.11-51 10 H1_Night y52364mw + + - + + + + Ref GDB-HW-10-FULL Group DeBo_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
48 06:41:52 20250731-1435-B400_B.11-48 13 H1_C13_HMBC_US_Night y52364mw - + - - - + + Ref GDB-HW-4-FULL-1 Group DeBo_G
48 06:26:38 20250731-1435-B400_B.11-48 12 H1_C13_HSQC_US_Night y52364mw - + - - - + + Ref GDB-HW-4-FULL-1 Group DeBo_G
48 05:32:53 20250731-1435-B400_B.11-48 11 C13_CPD_Night1024 y52364mw - + - - - + + Ref GDB-HW-4-FULL-1 Group DeBo_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
48 05:28:00 20250731-1435-B400_B.11-48 10 H1_Night y52364mw + + - + + + + Ref GDB-HW-4-FULL-1 Group DeBo_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
35 05:00:45 20250731-1408-B400_B.11-35 17 C13_DEPT135_Night z88883sp - + - - - + + Ref SP366 Group Romanov_A sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
35 04:33:25 20250731-1408-B400_B.11-35 16 C13_DEPT90_Night z88883sp - + - - - + + Ref SP366 Group Romanov_A sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
35 03:58:16 20250731-1408-B400_B.11-35 15 H1_C13_HMBC_Night z88883sp - + - - - + + Ref SP366 Group Romanov_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
35 03:42:54 20250731-1408-B400_B.11-35 14 H1_C13_HSQC_Night z88883sp - + - - - + + Ref SP366 Group Romanov_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
35 03:29:26 20250731-1408-B400_B.11-35 13 H1_COSY_HiRes_Night z88883sp - + - - - + + Ref SP366 Group Romanov_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
35 02:35:40 20250731-1408-B400_B.11-35 12 C13_CPD_Night1024 z88883sp - + - - - + + Ref SP366 Group Romanov_A sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
35 02:29:20 20250731-1408-B400_B.11-35 11 H1_Night z88883sp + + - + + + + Ref SP366 Group Romanov_A
42 01:00:46 20250731-0907-B400_B.11-42 10 H1_Night1024 x25009jo + + - + + + + Ref GDB-JO-864-K2_M Group DeBo_G
41 23:32:04 20250731-0907-B400_B.11-41 10 H1_Night1024 x25009jo + + - + + + + Ref GDB-JO-864-K2_P Group DeBo_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
59 22:54:42 20250730-1716-B400_B.11-59 14 H1_C13_HMBC_US_Night y52364mw + + - + + + + Ref GDB-HW-9-FULL Group DeBo_G
6 22:39:14 20250731-2229-B400_B.11-6 10 H1_Night128 m09677nb + + - + + + + Ref nhbn zincke imine Group Greaney_M
59 22:21:25 20250730-1716-B400_B.11-59 13 H1_C13_HSQC_US_Night y52364mw + + - + + + + Ref GDB-HW-9-FULL Group DeBo_G
5 22:05:33 20250731-1948-B400_B.11-5 10 H1_Night128 m09677nb + + - + + + + Ref ome cf2cl Group Greaney_M
59 19:26:49 20250730-1716-B400_B.11-59 12 H1_COSY_NS64_Night y52364mw + + - + + + x Ref GDB-HW-9-FULL Group DeBo_G calcphhomo: phase correction aborted magnitude or undefined data, calcphhomo: phase correction aborted magnitude or undefined data
25 19:14:01 20250731-1822-B400_B.11-23 30 H1_Quant_D1_25s_Day n38871ln + + - + + + + Ref ln95-3 4 h Group Larrosa_I
24 18:59:55 20250731-1822-B400_B.11-23 20 H1_Quant_D1_25s_Day n38871ln + + - + + + + Ref ln95-2 4 h Group Larrosa_I
23 18:47:17 20250731-1822-B400_B.11-23 10 H1_Quant_D1_25s_Day n38871ln + + - + + + + Ref ln95-1 4 h Group Larrosa_I
44 18:47:07 20250731-1745-B400_B.11-44 12 F19_NoCPD_Night m90460ad - x - - - - - Ref mfg-ad-424b Group Greaney_M ATMA Select Nucleus failed, ATM Failed
44 18:35:32 20250731-1745-B400_B.11-44 11 H1_Night128 m90460ad - + - - - + + Ref mfg-ad-424b Group Greaney_M
44 18:28:41 20250731-1745-B400_B.11-44 10 H1_Night m90460ad + + - + + + + Ref mfg-ad-424b Group Greaney_M
43 18:23:58 20250731-1744-B400_B.11-43 10 H1_Night m90460ad + + - + + + + Ref mfg-ad-429 Group Greaney_M
22 18:09:31 20250731-1742-B400_B.11-22 10 H1_Night128 y59240mb + + - + + + + Ref 100 microlit p 5 x 5 bac AD supress water Group McDonald_T 100 microlit p 5 x 5 bac AD suppress sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
40 17:53:17 20250731-1431-B400_B.11-40 10 C13_CPD_Night256 b32507dt + + - + + + + Ref dtg31 Group Webb_S sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
39 17:36:35 20250731-1430-B400_B.11-39 10 C13_CPD_Night256 b32507dt + + - + + + + Ref dtg33 Group Webb_S
16 17:32:03 20250731-1633-B400_B.11-16 10 H1_Day b32507dt + + - + + + + Ref dt157 29 31 Group Webb_S
15 17:27:34 20250731-1633-B400_B.11-15 10 H1_Day b32507dt + + - + + + + Ref dt157 14 15 Group Webb_S
14 17:23:30 20250731-1632-B400_B.11-14 10 H1_Day n31353oc + + - + + + + Ref djp-oc-775-is Group Procter_D
13 17:18:02 20250731-1629-B400_B.11-13 10 H1_Day c62220rg + + - + + + + Ref at-rg-4-64 1 h Group Trowbridge_A sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
12 17:13:14 20250731-1629-B400_B.11-12 10 H1_Day c62220rg + + - + + + + Ref at-rg-4-64 1 h Group Trowbridge_A sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
11 17:08:23 20250731-1629-B400_B.11-11 10 H1_Day c62220rg + + - + + + + Ref at-rg-4-64 1 h Group Trowbridge_A sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
10 17:05:06 20250731-1032-B400_B.11-10 16 H1_Day v67557bm + + - + + + + Ref BM803 Group Willcox_D
9 17:00:47 20250731-1629-B400_B.11-9 10 H1_Day16 u15978mt + + - + + + + Ref DPNI_5050_3hours Group Anderson_M sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
8 16:55:56 20250731-1627-B400_B.11-8 10 H1_Day16 u15978mt + + - + + + + Ref DPNI_5050_2hours Group Anderson_M sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
7 16:52:31 20250731-1622-B400_B.11-7 10 H1_Day m52750pm + + - + + + + Ref GCPM100cru Group Crisenza_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
6 16:48:23 20250731-1447-B400_B.11-6 10 H1_Day t91715jk + + - + + + + Ref JK086 DP200 tfinal in chloro Group Gibson_M JK086 DP200 tfinal in chloro sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
5 16:44:11 20250731-1619-B400_B.11-5 10 H1_Day16 h55599rb + + - + + + + Ref RB-9-556 Group Procter_D sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
60 16:39:55 20250731-1604-B400_B.11-60 10 H1_Day16 u15978mt + + - + + + + Ref DPNI_ligandonly_no_acid Group Anderson_M sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
58 16:35:22 20250731-1602-B400_B.11-58 10 H1_Day16 u15978mt + + - + + + + Ref DPNI_acid_ligandonly Group Anderson_M sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
57 16:33:19 20250731-1559-B400_B.11-57 11 F19_NoCPD_Day j83970qc - + - - - + + Ref qc e605 p2 Group DeBo_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: reference peak outside file limits default calibration done, sref: reference peak outside file limits default calibration done
57 16:29:12 20250731-1559-B400_B.11-57 10 H1_Day16 j83970qc + + - + + + + Ref qc e605 p2 Group DeBo_G
56 16:27:04 20250731-1559-B400_B.11-56 11 F19_NoCPD_Day j83970qc - + - - - + + Ref qc e605 p1 Group DeBo_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: reference peak outside file limits default calibration done, sref: reference peak outside file limits default calibration done
56 16:22:17 20250731-1559-B400_B.11-56 10 H1_Day16 j83970qc + + - + + + + Ref qc e605 p1 Group DeBo_G
55 16:17:23 20250731-1558-B400_B.11-55 10 H1_Day16 g16660ml + + - + + + + Ref djp-muze Group Procter_D sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
54 16:11:59 20250731-1558-B400_B.11-54 10 H1_Day16 g16660ml + + - + + + + Ref djp-muze Group Procter_D sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
53 15:59:20 20250731-1543-B400_B.11-53 10 H1_Quant_D1_25s_Day g23544jd + + - + + + + Ref MJJ-JDL-05-029-12 Group James_M sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
52 15:54:07 20250731-1529-B400_B.11-52 10 H1_Day b26045ab + + - + + + + Ref AT-ABO-02-417-P2 Group Trowbridge_A sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
50 15:49:21 20250731-1529-B400_B.11-50 10 H1_Day b26045ab + + - + + + + Ref AT-ABO-02-417-P1-2 Group Trowbridge_A sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
49 15:45:49 20250731-1529-B400_B.11-49 10 H1_Day b26045ab + + - + + + + Ref AT-ABO-02-417-P1 Group Trowbridge_A sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
47 15:43:54 20250731-1524-B400_B.11-47 11 C13_CPD_Day u67812sg - + - - - + + Ref sq-01-137-1 Group Procter_D sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
47 15:39:28 20250731-1524-B400_B.11-47 10 H1_Day u67812sg + + - + + + + Ref sq-01-137-1 Group Procter_D sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
46 15:36:46 20250731-1524-B400_B.11-46 11 C13_CPD_Day u67812sg - + - - - + + Ref sq-01-136 Group Procter_D sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
46 15:31:37 20250731-1524-B400_B.11-46 10 H1_Day u67812sg + + - + + + + Ref sq-01-136 Group Procter_D sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
45 15:27:06 20250731-1516-B400_B.11-45 10 H1_Day z88883sp + + - + + + + Ref SP365b Group Romanov_A Second crop of ppt
44 15:19:57 20250731-1502-B400_B.11-44 10 H1_Day16 x25009jo + + - + + + + Ref GDB-JO-882-m1h Group DeBo_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
43 15:14:04 20250731-1432-B400_B.11-43 11 H1_COSY_Day b32507dt - + - - - + + Ref dtgsugari 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
43 15:10:13 20250731-1432-B400_B.11-43 10 H1_Day b32507dt + + - + + + + Ref dtgsugari Group Webb_S
38 15:04:03 20250731-1426-B400_B.11-38 10 H1_Day16 z40241jm + + - + + + + Ref DJP-JIM-7-042-2a-fullchar Group Procter_D
37 15:01:39 20250731-1417-B400_B.11-37 12 P31_Wide_Day b50715cd - + - - - + + Ref LPG075 Group Goodwin_C LPG075 - oDFB - 31P
37 14:59:45 20250731-1417-B400_B.11-37 11 C13_CPD_Day b50715cd - + - - - + + Ref LPG075 Group Goodwin_C LPG075 - oDFB - 13C pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Goodwin_C/data/b50715cd/nmr/20250731-1417-B400_B.11-37/11/pdata/1/peaks!, pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Goodwin_C/data/b50715cd/nmr/20250731-1417-B400_B.11-37/11/pdata/1/peaks!
37 14:57:03 20250731-1417-B400_B.11-37 10 H1_Wide_Day b50715cd + + - + + + + Ref LPG075 Group Goodwin_C LPG075 - oDFB - 1H pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Goodwin_C/data/b50715cd/nmr/20250731-1417-B400_B.11-37/10/pdata/1/peaks!, pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Goodwin_C/data/b50715cd/nmr/20250731-1417-B400_B.11-37/10/pdata/1/peaks!
36 14:51:35 20250731-1412-B400_B.11-36 10 H1_Day n31353oc + + - + + + + Ref djp-oc-766-is Group Procter_D sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
35 14:47:26 20250731-1408-B400_B.11-35 10 H1_Day z88883sp + + - + x + + Ref SP366 Group Romanov_A topshim: TopshimFieldMap - no valid data in sample centre, Shim failed
34 14:40:35 20250731-1336-B400_B.11-34 10 H1_WaterSupp_Day f56027ch + + - + + + + Ref S6 -1.0v Group Schroder_M sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
33 14:32:59 20250731-1336-B400_B.11-33 10 H1_WaterSupp_Day f56027ch + + - + + + + Ref S6 -0.9v Group Schroder_M sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
32 14:28:53 20250731-1354-B400_B.11-32 10 H1_Day16 u15978mt + + - + + + + Ref DPNI_5050_60mins Group Anderson_M sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
31 14:24:48 20250731-1353-B400_B.11-31 10 H1_Day16 u15978mt + + - + + + + Ref DPNI_5050_30mins Group Anderson_M sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
30 14:21:17 20250731-1340-B400_B.11-30 10 H1_Day x73847lm + + - + + + + Ref IR-LJM-01-108 Group Riddell_I sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
29 14:14:20 20250731-1336-B400_B.11-29 10 H1_WaterSupp_Day f56027ch + + - + + + + Ref S6 -0.8v Group Schroder_M sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
28 14:07:15 20250731-1336-B400_B.11-28 10 H1_WaterSupp_Day f56027ch + + - + + + + Ref S6 -0.7v Group Schroder_M sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
27 14:00:09 20250731-1336-B400_B.11-27 10 H1_WaterSupp_Day f56027ch + + - + + + + Ref S6 -0.6v Group Schroder_M sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
26 13:58:08 20250731-1331-B400_B.11-26 11 C13_CPD_Day p69174hv - + - - - + + Ref GC-HV Cy11 Product Group Crisenza_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
26 13:52:45 20250731-1331-B400_B.11-26 10 H1_Day p69174hv + + - + + + + Ref GC-HV Cy11 Product Group Crisenza_G
25 13:50:41 20250731-1330-B400_B.11-25 12 F19_NoCPD_Day p69174hv - + - - - + + Ref GC-HV Cy18 Product 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
25 13:48:46 20250731-1330-B400_B.11-25 11 C13_CPD_Day p69174hv - + - - - + + Ref GC-HV Cy18 Product Group Crisenza_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
25 13:44:17 20250731-1330-B400_B.11-25 10 H1_Day p69174hv + + - + + + + Ref GC-HV Cy18 Product Group Crisenza_G
24 13:42:15 20250731-1328-B400_B.11-24 11 C13_CPD_Day p69174hv - + - - - + + Ref GC-HV RO9 Product Group Crisenza_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
24 13:37:40 20250731-1328-B400_B.11-24 10 H1_Day p69174hv + + - + + + + Ref GC-HV RO9 Product Group Crisenza_G
23 13:35:34 20250731-1327-B400_B.11-23 12 F19_NoCPD_Day p69174hv - + - - - + + Ref GC-HV Cy21 Product 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; pp: Cannot find any peak for scaling in /mnt/nmrdata/Crisenza_G/data/p69174hv/nmr/20250731-1327-B400_B.11-23/12/pdata/1/peaks!, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0; pp: Cannot find any peak for scaling in /mnt/nmrdata/Crisenza_G/data/p69174hv/nmr/20250731-1327-B400_B.11-23/12/pdata/1/peaks!
23 13:33:39 20250731-1327-B400_B.11-23 11 C13_CPD_Day p69174hv - + - - - + + Ref GC-HV Cy21 Product Group Crisenza_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
23 13:28:16 20250731-1327-B400_B.11-23 10 H1_Day p69174hv + + - + + + + Ref GC-HV Cy21 Product Group Crisenza_G
22 13:16:47 20250731-1316-B400_B.11-22 10 H1_Day16 x25009jo + + - + + + + Ref GDB-JO-880-NEt3 PNW Group DeBo_G
21 12:56:30 20250731-1255-B400_B.11-21 10 H1_Day v67557bm + + - + + + + Ref BM802 Group Willcox_D
19 12:44:28 20250731-1240-B400_B.11-19 10 H1_Day g2777ec + + - + + + + Ref RWEC-I-122 Group Winpenny_R
18 12:39:50 20250731-1239-B400_B.11-18 10 H1_Day16 u15978mt + + - + + + + Ref DPNI_5050_24hrs Group Anderson_M sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
1 12:23:19 20250731-1222-B400_B.11-1 10 H1_Day mbdxrbj2 + + - + + + + Ref BJ553_PC Group Procter_D sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
10 12:18:32 20250731-1032-B400_B.11-10 12 H1_Night mbdxkrn2 x - - - - - - Ref sd008-exo-pure-conc Group DeBo_G WebService Error: 103.310.145:Sample Missing Error:No sample found with Position or Tube ID '1.10'.
17 12:14:05 20250731-1210-B400_B.11-17 10 H1_Day16 f85241bm + + - + + + + Ref BM941-1 Group Bures_J sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
16 12:10:52 20250731-1201-B400_B.11-16 10 H1_Day h68355ac + + - + + + + Ref MFG-AC-597-(b) Group Greaney_M
15 12:06:46 20250731-1201-B400_B.11-15 10 H1_Day h68355ac + + - + + + + Ref MFG-AC-597-(a) Group Greaney_M sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
14 12:01:03 20250731-1149-B400_B.11-14 10 H1_Day16 a15978el + + - + + + + Ref EL-03-207-c Group James_M
13 11:56:40 20250731-1148-B400_B.11-13 10 H1_Day16 h91839em + + - + + + + Ref GC EM 71 F2 Group Crisenza_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
12 11:51:57 20250731-1147-B400_B.11-12 10 H1_Day16 h91839em + + - + + + + Ref GC EM 71 F1 Group Crisenza_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
11 11:47:48 20250731-1137-B400_B.11-11 10 H1_Day16 x25009jo + + - + + + + Ref GDB-JO-880-DBU NW Group DeBo_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
10 11:30:37 20250731-1032-B400_B.11-10 11 C13_CPD_Night256 mbdxkrn2 + + - + + + + Ref sd008-exo-pure-conc Group DeBo_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
20 11:27:28 20250731-1119-B400_B.11-20 10 H1_Day q80578pk + + - + + + + Ref MJJ-PK-01-008-H2O Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
19 11:23:47 20250731-1041-B400_B.11-19 10 H1_Day q80578pk + + - + + + + Ref MJJ-PK-01-010-1+H2O Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
15 11:18:45 20250731-1055-B400_B.11-15 10 H1_Day16 h55599rb + + - + + + + Ref RB-silylether Group Procter_D
14 11:15:19 20250731-1039-B400_B.11-14 10 H1_Day q80578pk + + - + + + + Ref MJJ-PK-01-008-Xylene Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
13 11:12:16 20250731-1039-B400_B.11-13 10 H1_Day q80578pk + + - + + + + Ref MJJ-PK-01-008-MeCN Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
12 11:08:47 20250731-1038-B400_B.11-12 10 H1_Day q80578pk + + - + + + + Ref MJJ-PK-01-008-MeOH Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
11 11:03:12 20250731-1034-B400_B.11-11 10 H1_Day16 mbdxkrn2 + + - + + + + Ref GDB-RN1550(ii) Crude - Acetone-d6 Group DeBo_G
10 10:58:42 20250731-1032-B400_B.11-10 10 H1_Day16 mbdxkrn2 + + - + + + + Ref sd008-exo-pure-conc Group DeBo_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
9 10:55:36 20250731-1029-B400_B.11-9 10 H1_Day q80578pk + + - + + + + Ref MJJ-PK-01-008-DMF Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
8 10:52:33 20250731-1029-B400_B.11-8 10 H1_Day q80578pk + + - + + + + Ref MJJ-PK-01-008-Oct Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
7 10:49:08 20250731-1028-B400_B.11-7 10 H1_Day q80578pk + + - + + + + Ref MJJ-PK-01-008-Hept Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
6 10:45:23 20250731-1026-B400_B.11-6 10 H1_Day x25009jo + + - + + + + Ref GDB-JO-BPA Group DeBo_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
5 10:40:53 20250731-1023-B400_B.11-5 10 H1_Day m52750pm + + - + + + + Ref GCPM98cr Group Crisenza_G
4 10:36:50 20250731-1023-B400_B.11-4 10 H1_Day m52750pm + + - + + + + Ref GCPM97cr Group Crisenza_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
3 10:34:48 20250731-1012-B400_B.11-3 11 F19_NoCPD_Day w52164bc - + - - - + + Ref BC-11-041 P1 Group James_M 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
3 10:28:29 20250731-1012-B400_B.11-3 10 H1_Day16 w52164bc + + - + + + + Ref BC-11-041 P1 Group James_M
2 10:26:23 20250731-1012-B400_B.11-2 11 F19_NoCPD_Day w52164bc - + - - - + + Ref BC-11-045 P1 Group James_M 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 10:20:37 20250731-1012-B400_B.11-2 10 H1_Day16 w52164bc + + - + + + + Ref BC-11-045 P1 Group James_M
1 10:15:01 20250731-1011-B400_B.11-1 10 H1_Day16 w52164bc + + - + + + + Ref BC-11-046 80 C Group James_M sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
60 09:47:51 20250731-0941-B400_B.11-60 12 Si29_DEPT90_Day b36621hr - + - - - + + Ref DPM-HR194-HAs'' 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/b36621hr/nmr/20250731-0941-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/Mills_D/data/b36621hr/nmr/20250731-0941-B400_B.11-60/12/pdata/1/peaks!
60 09:45:56 20250731-0941-B400_B.11-60 11 C13_CPD_Day b36621hr - + - - - + + Ref DPM-HR194-HAs'' Group Mills_D
60 09:42:32 20250731-0941-B400_B.11-60 10 H1_Day b36621hr + + - + + + + Ref DPM-HR194-HAs'' Group Mills_D
58 08:39:00 20250731-0833-B400_B.11-58 10 H1_Day16 x25009jo + + - + + + + Ref GDB-JO-DC + base Group DeBo_G
57 08:34:49 20250731-0833-B400_B.11-57 10 H1_Day16 x25009jo + + - + + + + Ref GDB-JO-DC Group DeBo_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
59 05:33:20 20250730-1716-B400_B.11-59 11 C13_CPD_Night1024 y52364mw - + - - - + + Ref GDB-HW-9-FULL Group DeBo_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
59 05:29:02 20250730-1716-B400_B.11-59 10 H1_Night y52364mw + + - + + + + Ref GDB-HW-9-FULL Group DeBo_G
16 04:00:36 20250730-1704-B400_B.11-16 10 H1_Night1024 y37570lc + + - + + + + Ref lc612-1 post sonc E1171 Group DeBo_G
15 02:31:39 20250730-1703-B400_B.11-15 10 H1_Night1024 y37570lc + + - + + + + Ref lc612-1 post sonc E1170 Group DeBo_G
8 02:27:32 20250730-1648-B400_B.11-8 11 C13_CPD_Day b36621hr + + - + + + + Ref DPM-HR-[Y(CH2C6H4-o-NMe2)3] in C6D6 Group Mills_D sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
6 01:49:56 20250730-1400-B400_B.11-6 15 H1_C13_HMBC_Night h68355ac + + - + + + + Ref MFG-AC-596-(a)-col Group Greaney_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
7 01:14:47 20250730-1338-B400_B.11-7 14 H1_C13_HMBC_Night w52164bc - + - - - + + Ref BC-11-042 P1 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
7 00:59:26 20250730-1338-B400_B.11-7 13 H1_C13_HSQC_Night w52164bc - + - - - + + Ref BC-11-042 P1 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
7 00:45:59 20250730-1338-B400_B.11-7 12 H1_COSY_HiRes_Night w52164bc - + - - - + + Ref BC-11-042 P1 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
7 00:43:45 20250730-1338-B400_B.11-7 11 H1_Night w52164bc - + - - - + + Ref BC-11-042 P1 Group James_M
7 23:46:41 20250730-1338-B400_B.11-7 10 C13_CPD_Night1024 w52164bc + + - + + + + Ref BC-11-042 P1 Group James_M sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
54 23:33:11 20250730-1041-B400_B.11-54 15 H1_COSY_HiRes_Night mbdxkrn2 - + - - - + + Ref sd007endo pure Group DeBo_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
54 23:17:50 20250730-1041-B400_B.11-54 14 H1_C13_HSQC_Night mbdxkrn2 - + - - - + + Ref sd007endo pure Group DeBo_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
54 22:42:41 20250730-1041-B400_B.11-54 13 H1_C13_HMBC_Night mbdxkrn2 - + - - - + + Ref sd007endo pure Group DeBo_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
54 22:37:58 20250730-1041-B400_B.11-54 12 H1_Night mbdxkrn2 + + - + + + + Ref sd007endo pure Group DeBo_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
56 22:31:03 20250730-2205-B400_B.11-56 10 H1_Night y52364mw + + - + + + + Ref GDB-MJ-137-P2 Group DeBo_G
55 22:25:17 20250730-2204-B400_B.11-55 10 H1_Night y52364mw + + - + + + + Ref GDB-MJ-137-P1 Group DeBo_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
54 21:29:19 20250730-1041-B400_B.11-54 11 C13_CPD_Night1024 mbdxkrn2 + + - + + + + Ref sd007endo pure Group DeBo_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
48 20:52:19 20250730-0958-B400_B.11-48 14 H1_C13_HMBC_US_Night y52364mw + + - + + + + Ref GDB-HW-4-FULL Group DeBo_G
52 19:23:19 20250730-0850-B400_B.11-52 10 H1_Night1024 x25009jo + + - + + + + Ref GDB-JO-851-K2-PSNW Group DeBo_G
53 19:17:25 20250730-1825-B400_B.11-53 10 H1_Night y52364mw + + - + + + + Ref GDB-MJ-131-t6-1 Group DeBo_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
51 17:48:30 20250730-0850-B400_B.11-51 10 H1_Night1024 x25009jo + + - + + + + Ref GDB-JO-851-K1 PSNW Group DeBo_G
12 17:35:54 20250730-1106-B400_B.11-12 11 H1_Quant_D1_25s_Day q80578pk + + - + + + + Ref MJJ-PK-01-011-5-R-D Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
8 17:32:15 20250730-1648-B400_B.11-8 10 H1_Day b36621hr + + - + + + + Ref DPM-HR-[Y(CH2C6H4-o-NMe2)3] in C6D6 Group Mills_D sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
17 17:27:11 20250730-1703-B400_B.11-17 10 H1_Day16 j83970qc + + - + + + + Ref qc e580 r1 Group DeBo_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
14 17:21:44 20250730-1651-B400_B.11-14 12 Si29_DEPT90_Day b36621hr - + - - - + + Ref DPM-HR194-As(SiMe3)3+MeOH 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/b36621hr/nmr/20250730-1651-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/b36621hr/nmr/20250730-1651-B400_B.11-14/12/pdata/1/peaks!
14 17:19:19 20250730-1651-B400_B.11-14 11 C13_CPD_Day b36621hr - + - - - + + Ref DPM-HR194-As(SiMe3)3+MeOH Group Mills_D
14 17:15:59 20250730-1651-B400_B.11-14 10 H1_Day b36621hr + + - + + + + Ref DPM-HR194-As(SiMe3)3+MeOH Group Mills_D
13 17:12:58 20250730-1649-B400_B.11-13 13 P31_Wide_Day b36621hr - + - - - + + Ref DPM-HR193-YCl3 + 3NaPtt Group Mills_D sref: reference peak outside file limits default calibration done, sref: reference peak outside file limits default calibration done
13 17:07:32 20250730-1649-B400_B.11-13 12 Si29_DEPT90_Day b36621hr - + - - - + + Ref DPM-HR193-YCl3 + 3NaPtt 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/b36621hr/nmr/20250730-1649-B400_B.11-13/12/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/b36621hr/nmr/20250730-1649-B400_B.11-13/12/pdata/1/peaks!
13 17:05:00 20250730-1649-B400_B.11-13 11 C13_CPD_Day b36621hr - + - - - + + Ref DPM-HR193-YCl3 + 3NaPtt Group Mills_D sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
13 17:01:27 20250730-1649-B400_B.11-13 10 H1_Day b36621hr + + - + + + + Ref DPM-HR193-YCl3 + 3NaPtt Group Mills_D
11 16:49:26 20250730-1105-B400_B.11-11 11 H1_Quant_D1_25s_Day q80578pk + + - + + + + Ref MJJ-PK-01-011-2-R-D Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
5 16:36:46 20250730-1154-B400_B.11-5 10 H1_Quant_D1_25s_Day q80578pk + + - + + + + Ref MJJ-PK-01-010-1-0.5eq-40c-16h Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
53 16:30:35 20250724-1237-B400_B.11-53 13 H1_Day16 z40241jm + + - + + + + Ref DJP-JIM-7-042-2a-fullchar Group Procter_D
50 16:26:48 20250730-1559-B400_B.11-50 10 H1_Day t91715jk + + - + + + + Ref JK086 DP100 tfinal in chloro Group Gibson_M JK086 DP100 tfinal in chloro
21 16:24:45 20250730-1602-B400_B.11-21 11 F19_NoCPD_Day mbdxkrn2 - + - - - + + Ref sd008-exo-before purifi Group DeBo_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: reference peak outside file limits default calibration done; pp: Cannot find any peak for scaling in /mnt/nmrdata/DeBo_G/data/mbdxkrn2/nmr/20250730-1602-B400_B.11-21/11/pdata/1/peaks!, sref: reference peak outside file limits default calibration done; pp: Cannot find any peak for scaling in /mnt/nmrdata/DeBo_G/data/mbdxkrn2/nmr/20250730-1602-B400_B.11-21/11/pdata/1/peaks!
21 16:20:02 20250730-1602-B400_B.11-21 10 H1_Day16 mbdxkrn2 + + - + + + + Ref sd008-exo-before purifi Group DeBo_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
20 16:17:55 20250730-1556-B400_B.11-20 11 F19_NoCPD_Day mbdxrbj2 - + - - - + + Ref BJ555_PC 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
20 16:11:59 20250730-1556-B400_B.11-20 10 H1_Day mbdxrbj2 + + - + + + + Ref BJ555_PC Group Procter_D sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
19 16:07:35 20250730-1536-B400_B.11-19 11 P31_CPD_Day n51547cb - + - - - + + Ref 31P Ti=PH Rb Group Liddle_S sref: reference peak outside file limits default calibration done, sref: reference peak outside file limits default calibration done
19 16:04:08 20250730-1536-B400_B.11-19 10 H1_Day n51547cb + + - + + + + Ref 1H Ti=PH Rb Group Liddle_S
18 15:59:14 20250730-1534-B400_B.11-18 11 P31_CPD_Day n51547cb - + - - - + + Ref 31P ZrPH Rb Group Liddle_S sref: reference peak outside file limits default calibration done, sref: reference peak outside file limits default calibration done
18 15:56:00 20250730-1534-B400_B.11-18 10 H1_Day n51547cb + + - + + + + Ref 1H ZrPH Rb Group Liddle_S
17 15:51:33 20250730-1532-B400_B.11-17 10 H1_Day n51547cb + + - + + + + Ref 1H HfCl4(THF)2 Group Liddle_S sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
48 15:33:40 20250730-0958-B400_B.11-48 13 H1_C13_HSQC_US_Night y52364mw + + - + + + + Ref GDB-HW-4-FULL Group DeBo_G
13 15:26:15 20250730-1518-B400_B.11-13 10 H1_Day16 x25009jo + + - + + + + Ref GDB-JO-857-crude Group DeBo_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
10 15:13:41 20250730-1105-B400_B.11-10 11 H1_Quant_D1_25s_Day q80578pk + + - + + + + Ref MJJ-PK-01-010-1-0.5eq-D-2M-16h Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
9 15:08:34 20250730-1453-B400_B.11-9 10 H1_Day16 j83970qc + + - + + + + Ref qc e580 p1 Group DeBo_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
8 15:02:43 20250730-1424-B400_B.11-8 11 H1_Day16 z40241jm + + - + + + + Ref DJP-JIM-7-046-2a Group Procter_D
6 14:44:51 20250730-1400-B400_B.11-6 14 H1_C13_HSQC_Night h68355ac + + - + + + + Ref MFG-AC-596-(a)-col Group Greaney_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
8 14:36:50 20250730-1424-B400_B.11-8 10 H1_Day16 z40241jm + + - + + + + Ref DJP-JIM-7-042-1b-resubjected Group Procter_D
6 14:22:28 20250730-1400-B400_B.11-6 12 C13_CPD_Night256 h68355ac - + - - - + + Ref MFG-AC-596-(a)-col Group Greaney_M sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
6 14:16:47 20250730-1400-B400_B.11-6 11 H1_Night h68355ac + + - + + + + Ref MFG-AC-596-(a)-col Group Greaney_M sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
41 14:13:21 20250730-1357-B400_B.11-41 10 H1_Day t91715jk + + - + + + + Ref JK086 DP50 tfinal in chloro Group Gibson_M JK086 DP50 tfinal in chloro
8 14:07:47 20250730-1406-B400_B.11-8 10 H1_Day z88883sp + + - + + + + Ref SP365a Group Romanov_A Deprotected, ppted solid
6 14:04:03 20250730-1400-B400_B.11-6 10 H1_Day h68355ac + + - + + + + Ref MFG-AC-596-(a)-col Group Greaney_M sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
4 13:51:29 20250730-1102-B400_B.11-4 11 H1_Quant_D1_25s_Day q80578pk + + - + + + + Ref MJJ-PK-01-403016-D2M Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
6 13:49:27 20250730-1337-B400_B.11-6 11 F19_NoCPD_Day w52164bc - + - - - + + Ref BC-11-041 P1 Group James_M 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 13:43:59 20250730-1337-B400_B.11-6 10 H1_Day16 w52164bc + + - + + + + Ref BC-11-041 P1 Group James_M
3 13:31:55 20250730-1102-B400_B.11-3 11 H1_Quant_D1_25s_Day q80578pk + + - + + + + Ref MJJ-PK-01-403016-T-2M Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
2 13:19:31 20250730-1101-B400_B.11-2 11 H1_Quant_D1_25s_Day q80578pk + + - + + + + Ref MJJ-PK-01-403016 Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
50 13:16:04 20250730-1310-B400_B.11-50 10 H1_Day n31353oc + + - + + + + Ref djp-oc-762-dmso Group Procter_D sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
49 13:11:23 20250730-1310-B400_B.11-49 10 H1_Day n31353oc + + - + + + + Ref djp-oc-769-is Group Procter_D sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
48 12:56:00 20250730-0958-B400_B.11-48 12 H1_COSY_HiRes_Night y52364mw + + - + + + + Ref GDB-HW-4-FULL Group DeBo_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
49 12:51:36 20250730-1250-B400_B.11-49 10 H1_Day16 j83970qc + + - + + + + Ref qc e607 c workup Group DeBo_G
48 12:46:47 20250730-0958-B400_B.11-48 11 H1_Night y52364mw + + - + + + + Ref GDB-HW-4-FULL Group DeBo_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
17 12:41:15 20250730-1229-B400_B.11-17 10 H1_Day16 r57145lg + + - + + + + Ref capg_LPG_PGT003_crude Group Goodwin_C
16 12:39:12 20250730-1227-B400_B.11-16 11 F19_NoCPD_Day mbdxkrn2 - + - - - + + Ref GDB-RN1550(ii) Mixture after 3h at 50 oC - Acetone-d6 Group DeBo_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: reference peak outside file limits default calibration done, sref: reference peak outside file limits default calibration done
16 12:32:38 20250730-1227-B400_B.11-16 10 H1_Day16 mbdxkrn2 + + - + + + + Ref GDB-RN1550(ii) Mixture after 3h at 50 oC - Acetone-d6 Group DeBo_G
15 12:30:30 20250730-1220-B400_B.11-15 11 F19_NoCPD_Day h91839em - + - - - + + Ref gc em 70 mp 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 12:24:40 20250730-1220-B400_B.11-15 10 H1_Day16 h91839em + + - + + + + Ref gc em 70 mp Group Crisenza_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
14 12:11:57 20250730-1152-B400_B.11-14 11 H1_Quant_D1_25s_Day q80578pk + + - + + + + Ref MJJ-PK-01-008-1105016-T-2M Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
15 12:05:48 20250730-1156-B400_B.11-15 10 H1_Day x06125gb + + - + + + + Ref GCGB253F23 Group Crisenza_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
14 12:02:13 20250730-1152-B400_B.11-14 10 H1_Day q80578pk + + - + + + + Ref MJJ-PK-01-008-1105016-T-2M Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
13 11:56:48 20250730-1146-B400_B.11-13 10 H1_Day m52750pm + + - + + + + Ref GCPM96cr-dil1 Group Crisenza_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
12 11:53:44 20250730-1106-B400_B.11-12 10 H1_Day q80578pk + + - + + + + Ref MJJ-PK-01-011-5-R-D Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
11 11:50:38 20250730-1105-B400_B.11-11 10 H1_Day q80578pk + + - + + + + Ref MJJ-PK-01-011-2-R-D Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
10 11:47:34 20250730-1105-B400_B.11-10 10 H1_Day q80578pk + + - + + + + Ref MJJ-PK-01-010-1-0.5eq-D-2M-16h Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
9 11:43:46 20250730-1104-B400_B.11-9 10 H1_Day q80578pk + + - + + + + Ref MJJ-PK-01-010-1-0.5eq-40C-16h Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
5 11:41:14 20250730-1127-B400_B.11-5 11 C13_CPD_Day h91839em - + - - - + + Ref gc em 70 crude Group Crisenza_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
5 11:36:18 20250730-1127-B400_B.11-5 10 H1_Day16 h91839em + + - + + + + Ref gc em 70 crude Group Crisenza_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
4 11:33:14 20250730-1102-B400_B.11-4 10 H1_Day q80578pk + + - + + + + Ref MJJ-PK-01-403016-D2M Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
3 11:30:12 20250730-1102-B400_B.11-3 10 H1_Day q80578pk + + - + + + + Ref MJJ-PK-01-403016-T-2M Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
2 11:26:36 20250730-1101-B400_B.11-2 10 H1_Day q80578pk + + - + + + + Ref MJJ-PK-01-403016 Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
60 11:22:08 20250730-1114-B400_B.11-60 10 H1_Day x73847lm + + - + + + + Ref IR-LJM-01-107 F45 Group Riddell_I
59 11:16:16 20250730-1114-B400_B.11-59 10 H1_Day16 z40241jm + + - + + + + Ref DJP-JIM-7-047-1a Group Procter_D sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
58 11:11:51 20250730-1108-B400_B.11-58 10 H1_Day16 h91839em + + - + + + + Ref gc em 70 crude Group Crisenza_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
57 11:06:24 20250730-1044-B400_B.11-57 10 H1_Day mbdxrbj2 + + - + + + + Ref BJ553 Group Procter_D sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
56 11:03:06 20250730-1027-B400_B.11-56 10 H1_Day n31353oc + + - + + + + Ref djp-oc-764-crude Group Procter_D sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
55 10:59:09 20250723-1730-B400_B.11-55 12 H1_Day mbdxrbj2 + + - + + + + Ref BJ549 Group Procter_D sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
54 10:54:07 20250730-1041-B400_B.11-54 10 H1_Day16 mbdxkrn2 + + - + + + + Ref sd007endo pure Group DeBo_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
53 10:52:04 20250724-1237-B400_B.11-53 12 F19_NoCPD_Day mbdxrbj2 - + - - - + + Ref BJ555 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
53 10:48:12 20250724-1237-B400_B.11-53 11 H1_Day mbdxrbj2 + + - + + + + Ref BJ555 Group Procter_D sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
50 10:44:16 20250730-1023-B400_B.11-50 10 F19_NoCPD_Day j83970qc + + - + + + + Ref qc e605 r2 Group DeBo_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: reference peak outside file limits default calibration done, sref: reference peak outside file limits default calibration done
49 10:40:42 20250730-1023-B400_B.11-49 10 F19_NoCPD_Day j83970qc + + - + + + + Ref qc e605 c Group DeBo_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: reference peak outside file limits default calibration done, sref: reference peak outside file limits default calibration done
48 10:35:50 20250730-0958-B400_B.11-48 10 H1_Day16 y52364mw + + - + + + + Ref GDB-HW-4-FULL Group DeBo_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
47 10:31:17 20250730-0955-B400_B.11-47 10 H1_Day16 w52164bc + + - + + + + Ref BC-11-045 4-Ph Group James_M
46 10:26:42 20250730-0955-B400_B.11-46 10 H1_Day16 w52164bc + + - + + + + Ref BC-11-044 CO2Me Group James_M sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
45 10:24:36 20250730-0955-B400_B.11-45 11 F19_NoCPD_Day w52164bc - + - - - + + Ref BC-11-042 P1 Group James_M 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
45 10:18:22 20250730-0955-B400_B.11-45 10 H1_Day16 w52164bc + + - + + + + Ref BC-11-042 P1 Group James_M
44 10:13:45 20250730-0922-B400_B.11-44 10 H1_Day16 j83970qc + + - + + + + Ref qc e607c Group DeBo_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
43 10:11:49 20250730-0920-B400_B.11-43 11 P31_Wide_Day b36621hr - + - - - + + Ref DPM-HR192-[YPtt3] tol 85C 36 Hr Group Mills_D pp: Cannot find any peak for scaling in /mnt/nmrdata/Mills_D/data/b36621hr/nmr/20250730-0920-B400_B.11-43/11/pdata/1/peaks!, pp: Cannot find any peak for scaling in /mnt/nmrdata/Mills_D/data/b36621hr/nmr/20250730-0920-B400_B.11-43/11/pdata/1/peaks!
43 10:08:24 20250730-0920-B400_B.11-43 10 P31_Wide_Day b36621hr + + - + + + + Ref DPM-HR192-[YPtt3] tol 85C 36 Hr Group Mills_D
42 10:03:17 20250730-0848-B400_B.11-41 30 H1_Day16 n38871ln + + - + + + + Ref ln93-6 Group Larrosa_I
41 09:58:33 20250730-0848-B400_B.11-41 10 H1_Day16 n38871ln + + - + + + + Ref ln93-3 Group Larrosa_I
37 09:53:48 20250730-0947-B400_B.11-37 10 H1_Day16 mbdxkrn2 + + - + + + + Ref sd007-endo Group DeBo_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
36 09:52:16 20250730-0915-B400_B.11-36 12 B11_NoCPD_Day m69065je - + - - - + + Ref JEK599_rt_t5d Group Mills_D JEK599_rt_t5d 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/20250730-0915-B400_B.11-36/12/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/Mills_D/data/m69065je/nmr/20250730-0915-B400_B.11-36/12/pdata/1/peaks!
36 09:46:32 20250730-0915-B400_B.11-36 11 Si29_DEPT90_Day m69065je - + - - - + + Ref JEK599_rt_t5d Group Mills_D JEK599_rt_t5d 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/20250730-0915-B400_B.11-36/11/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/m69065je/nmr/20250730-0915-B400_B.11-36/11/pdata/1/peaks!
36 09:42:13 20250730-0915-B400_B.11-36 10 H1_Day16 m69065je + + - + + + + Ref JEK599_rt_t5d Group Mills_D JEK599_rt_t5d sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
33 09:36:42 20250730-0847-B400_B.11-33 10 H1_Day16 n38871ln + + - + + + + Ref ln93-5 Group Larrosa_I
32 09:32:30 20250730-0847-B400_B.11-32 10 H1_Day16 n38871ln + + - + + + + Ref ln93-4 Group Larrosa_I
31 09:19:05 20250730-0843-B400_B.11-31 10 H1_Quant_D1_25s_Day n38871ln + + - + + + + Ref ln93-1 Group Larrosa_I
28 09:13:54 20250730-0845-B400_B.11-28 10 H1_Day16 n38871ln + + - + + + + Ref ln93-2 Group Larrosa_I
27 09:07:18 20250729-2224-B400_B.11-27 10 H1_WaterSupp_Day f56027ch + + - + + + + Ref S20 -1.2v Group Schroder_M sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
26 09:00:17 20250729-2224-B400_B.11-26 10 H1_WaterSupp_Day f56027ch + + - + + + + Ref S20 -1.1v Group Schroder_M sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
25 08:53:01 20250729-2224-B400_B.11-25 10 H1_WaterSupp_Day f56027ch + + - + + + + Ref S20 -1.0v Group Schroder_M sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
24 08:45:39 20250729-2224-B400_B.11-24 10 H1_WaterSupp_Day f56027ch + + - + + + + Ref S20 -0.9v Group Schroder_M sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
28 08:31:20 20250730-0829-B400_B.11-28 10 H1_Night128 mbdxkrn2 + + - + + + + Ref GDB-RN1550(i) Crude - Acetone-d6 Group DeBo_G
23 08:24:14 20250729-2224-B400_B.11-23 10 H1_WaterSupp_Day f56027ch + + - + + + + Ref S20 -0.8v Group Schroder_M sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
22 08:17:21 20250729-2224-B400_B.11-22 10 H1_WaterSupp_Day f56027ch + + - + + + + Ref S6 -1.2v Group Schroder_M sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
21 08:10:12 20250729-2224-B400_B.11-21 10 H1_WaterSupp_Day f56027ch + + - + + + + Ref S6 -1.1v Group Schroder_M sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
20 08:03:14 20250729-2224-B400_B.11-20 10 H1_WaterSupp_Day f56027ch + + - + + + + Ref S6 -1.0v Group Schroder_M sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
19 07:56:37 20250729-2224-B400_B.11-19 10 H1_WaterSupp_Day f56027ch + + - + + + + Ref S6 -0.9v Group Schroder_M sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
18 07:48:47 20250729-2224-B400_B.11-18 10 H1_WaterSupp_Day f56027ch + + - + + + + Ref S6 -0.8v Group Schroder_M sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
13 06:19:45 20250729-1801-B400_B.11-13 10 H1_Night1024 y37570lc + + - + + + + Ref gdb-rs-103-1 retry 400mhz 1000 scans Group DeBo_G
17 05:54:08 20250729-1618-B400_B.11-17 14 P31_Wide_Night a76294rm - + - - - + + Ref REM-P6 Group Goodwin_C pp: Cannot find any peak for scaling in /mnt/nmrdata/Goodwin_C/data/a76294rm/nmr/20250729-1618-B400_B.11-17/14/pdata/1/peaks!, pp: Cannot find any peak for scaling in /mnt/nmrdata/Goodwin_C/data/a76294rm/nmr/20250729-1618-B400_B.11-17/14/pdata/1/peaks!
17 05:26:57 20250729-1618-B400_B.11-17 13 P31_Wide_Night a76294rm + + - + + + + Ref REM-P6 Group Goodwin_C pp: Cannot find any peak for scaling in /mnt/nmrdata/Goodwin_C/data/a76294rm/nmr/20250729-1618-B400_B.11-17/13/pdata/1/peaks!, pp: Cannot find any peak for scaling in /mnt/nmrdata/Goodwin_C/data/a76294rm/nmr/20250729-1618-B400_B.11-17/13/pdata/1/peaks!
15 05:22:37 20250729-1603-B400_B.11-15 15 C13_DEPT135_Day z69889rb - + - - - + + Ref SE130B Group Crisenza_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
15 04:44:59 20250729-1603-B400_B.11-15 14 H1_C13_HMBC_Night z69889rb + + - + + + + Ref SE130B 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
12 04:31:31 20250729-1138-B400_B.11-12 14 H1_COSY_HiRes_Night mbdxkrn2 - + - - - + + Ref exo2 sd007 Group DeBo_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 04:16:10 20250729-1138-B400_B.11-12 13 H1_C13_HSQC_Night mbdxkrn2 - + - - - + + Ref exo2 sd007 Group DeBo_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 03:41:00 20250729-1138-B400_B.11-12 12 H1_C13_HMBC_Night mbdxkrn2 - + - - - + + Ref exo2 sd007 Group DeBo_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 03:38:41 20250729-1138-B400_B.11-12 11 H1_Night mbdxkrn2 - + - - - + + Ref exo2 sd007 Group DeBo_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
12 02:42:49 20250729-1138-B400_B.11-12 10 C13_CPD_Night1024 mbdxkrn2 + + - + + + + Ref exo2 sd007 Group DeBo_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
32 01:14:10 20250729-1127-B400_B.11-32 10 H1_Night1024 x25009jo + + - + + + + Ref GDB-JO-864-K1-M Group DeBo_G
31 23:45:15 20250729-1127-B400_B.11-31 10 H1_Night1024 x25009jo + + - + + + + Ref GDB-JO-864-K1-P Group DeBo_G
16 23:29:54 20250729-1109-B400_B.11-16 15 H1_C13_HSQC_Night e14150oc - + - - - + + Ref DS003.1 Group Winpenny_R 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 22:51:02 20250729-1109-B400_B.11-16 14 H1_C13_HMBC_Night e14150oc + + - + + + + Ref DS003.1 Group Winpenny_R 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 22:50:52 20250729-1037-B400_B.11-1 15 F19_NoCPD_Night b72547am - x - - - - - Ref 4-223 FC Group Larrosa_I ATMA Select Nucleus failed, ATM Failed
1 22:15:43 20250729-1037-B400_B.11-1 14 H1_C13_HMBC_Night b72547am - + - - - + + Ref 4-223 FC 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
1 22:00:21 20250729-1037-B400_B.11-1 13 H1_C13_HSQC_Night b72547am - + - - - + + Ref 4-223 FC 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
1 21:46:55 20250729-1037-B400_B.11-1 12 H1_COSY_HiRes_Night b72547am - + - - - + + Ref 4-223 FC 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
1 20:50:26 20250729-1037-B400_B.11-1 11 C13_CPD_Night1024 b72547am + + - + + + + Ref 4-223 FC Group Larrosa_I sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
7 20:46:02 20250729-2034-B400_B.11-7 10 H1_Day q62112nk + + - + + + + Ref djp-nk-1-176cr Group Procter_D
6 20:31:45 20250729-1921-B400_B.11-6 10 H1_Night128 m09677nb + + - + + + + Ref 4-ome Group Greaney_M
5 19:03:08 20250729-1011-B400_B.11-5 11 H1_Night1024 y37570lc + + - + + + + Ref lc613-3 Group DeBo_G
4 17:34:01 20250729-1011-B400_B.11-4 11 H1_Night1024 y37570lc + + - + + + + Ref lc613-2 Group DeBo_G
18 17:29:55 20250729-1729-B400_B.11-18 10 H1_Day m52750pm + + - + + + + Ref GCPM95d1 Group Crisenza_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
15 17:00:16 20250729-1603-B400_B.11-15 13 H1_C13_HSQC_Night z69889rb - + - - - + + Ref SE130B 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 16:43:13 20250729-1603-B400_B.11-15 12 H1_COSY_HiRes_Night z69889rb + + - + + + + Ref SE130B 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
17 16:39:29 20250729-1618-B400_B.11-17 12 Si29_CPD_Day a76294rm - + - - - + + Ref REM-P6 Group Goodwin_C pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Goodwin_C/data/a76294rm/nmr/20250729-1618-B400_B.11-17/12/pdata/1/peaks!, pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Goodwin_C/data/a76294rm/nmr/20250729-1618-B400_B.11-17/12/pdata/1/peaks!
17 16:37:46 20250729-1618-B400_B.11-17 11 P31_CPD_Day a76294rm - + - - - + + Ref REM-P6 Group Goodwin_C pp: Cannot find any peak for scaling in /mnt/nmrdata/Goodwin_C/data/a76294rm/nmr/20250729-1618-B400_B.11-17/11/pdata/1/peaks!, pp: Cannot find any peak for scaling in /mnt/nmrdata/Goodwin_C/data/a76294rm/nmr/20250729-1618-B400_B.11-17/11/pdata/1/peaks!
17 16:34:18 20250729-1618-B400_B.11-17 10 P31_Wide_Day a76294rm + + - + + + + Ref REM-P6 Group Goodwin_C pp: Cannot find any peak for scaling in /mnt/nmrdata/Goodwin_C/data/a76294rm/nmr/20250729-1618-B400_B.11-17/10/pdata/1/peaks!, pp: Cannot find any peak for scaling in /mnt/nmrdata/Goodwin_C/data/a76294rm/nmr/20250729-1618-B400_B.11-17/10/pdata/1/peaks!
15 16:19:56 20250729-1603-B400_B.11-15 11 C13_CPD_Night256 z69889rb - + - - - + + Ref SE130B Group Crisenza_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
15 16:14:02 20250729-1603-B400_B.11-15 10 H1_Night z69889rb + + - + + + + Ref SE130B Group Crisenza_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
17 16:10:34 20250729-1609-B400_B.11-17 10 H1_Day z69889rb + + - + + + + Ref RB236 Group Crisenza_G
14 16:06:25 20250729-1605-B400_B.11-14 10 H1_Day16 y52364mw + + - + + + + Ref GDB-HW-9 Group DeBo_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
13 16:02:21 20250729-1601-B400_B.11-13 10 H1_Day z69889rb + + - + + + + Ref RB235 Group Crisenza_G
27 15:43:12 20250729-1142-B400_B.11-27 11 H1_Quant_D1_25s_Day q80578pk + + - + + + + Ref MJJ-PK-01-012-11 Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
34 15:42:32 20250729-1231-B400_B.11-34 11 F19_NoCPD_Night j83970qc + x - - - - - Ref qc e605c Group DeBo_G ATMA Select Nucleus failed, ATM Failed
33 15:29:44 20250729-1144-B400_B.11-33 11 H1_Quant_D1_25s_Day q80578pk + + - + + + + Ref MJJ-PK-01-012-0 Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
44 15:24:01 20250729-1522-B400_B.11-44 10 H1_Day z69889rb + + - + + + + Ref SE132B Group Crisenza_G
28 15:19:17 20250729-1513-B400_B.11-28 10 H1_Day16 j83970qc + + - + + + + Ref qc 142-2 checking Group DeBo_G
26 15:07:12 20250729-1142-B400_B.11-26 11 H1_Quant_D1_25s_Day q80578pk + + - + + + + Ref MJJ-PK-01-012-10 Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
25 14:54:39 20250729-1142-B400_B.11-25 11 H1_Quant_D1_25s_Day q80578pk + + - + + + + Ref MJJ-PK-01-012-9 Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
28 14:50:54 20250729-1445-B400_B.11-28 10 H1_Day z40973rs + + - + + + + Ref gdb-rs-103-1 retry 400mhz Group DeBo_G
24 14:38:18 20250729-1142-B400_B.11-24 11 H1_Quant_D1_25s_Day q80578pk + + - + + + + Ref MJJ-PK-01-012-8 Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
19 14:26:05 20250729-1136-B400_B.11-19 11 H1_Quant_D1_25s_Day q80578pk + + - + + + + Ref MJJ-PK-01-012-7 Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
18 14:13:49 20250729-1136-B400_B.11-18 11 H1_Quant_D1_25s_Day q80578pk + + - + + + + Ref MJJ-PK-01-012-6 Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
17 14:01:12 20250729-1136-B400_B.11-17 11 H1_Quant_D1_25s_Day q80578pk + + - + + + + Ref MJJ-PK-01-012-5 Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
11 13:57:43 20250729-1137-B400_B.11-11 11 H1_Day j20588jh + + - + + + + Ref JH-DW-26.22.1-DippZnAlCl TMSN3 Styrene Group Willcox_D 5 days rt
10 13:45:36 20250729-1135-B400_B.11-10 11 H1_Quant_D1_25s_Day q80578pk + + - + + + + Ref MJJ-PK-01-012-4 Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
9 13:33:23 20250729-1135-B400_B.11-9 11 H1_Quant_D1_25s_Day q80578pk + + - + + + + Ref MJJ-PK-01-012-3 Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
8 13:20:27 20250729-1135-B400_B.11-8 11 H1_Quant_D1_25s_Day q80578pk + + - + + + + Ref MJJ-PK-01-012-2 Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
35 13:19:43 20250729-1231-B400_B.11-35 11 F19_NoCPD_Night j83970qc + x - - - - - Ref qc e605 r2 Group DeBo_G ATMA Select Nucleus failed, ATM Failed
43 13:15:25 20250729-1259-B400_B.11-43 10 C13_CPD_Day m52750pm + + - + + + + Ref GCPM96cr-Carb Group Crisenza_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
42 13:09:44 20250729-1256-B400_B.11-42 10 H1_Day q62112nk + + - + + + + Ref djp-nk-1-175 Group Procter_D sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
41 13:05:18 20250729-1232-B400_B.11-41 10 H1_Day16 j83970qc + + - + + + + Ref qc e603 Group DeBo_G
36 13:00:56 20250729-1232-B400_B.11-36 10 H1_Day16 j83970qc + + - + + + + Ref qc e602 Group DeBo_G
35 12:56:43 20250729-1231-B400_B.11-35 10 H1_Day16 j83970qc + + - + + + + Ref qc e605 r2 Group DeBo_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
34 12:52:03 20250729-1231-B400_B.11-34 10 H1_Day16 j83970qc + + - + + + + Ref qc e605c Group DeBo_G
33 12:48:35 20250729-1144-B400_B.11-33 10 H1_Day q80578pk + + - + + + + Ref MJJ-PK-01-012-0 Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
28 12:46:35 20250729-1228-B400_B.11-28 11 P31_Wide_Day b36621hr - + - - - + + Ref DPM-HR192-[YPtt3] Tol 85C 24h Group Mills_D pp: Cannot find any peak for scaling in /mnt/nmrdata/Mills_D/data/b36621hr/nmr/20250729-1228-B400_B.11-28/11/pdata/1/peaks!, pp: Cannot find any peak for scaling in /mnt/nmrdata/Mills_D/data/b36621hr/nmr/20250729-1228-B400_B.11-28/11/pdata/1/peaks!
28 12:43:26 20250729-1228-B400_B.11-28 10 P31_Wide_Day b36621hr + + - + + + + Ref DPM-HR192-[YPtt3] Tol 85C 24h Group Mills_D
27 12:40:20 20250729-1142-B400_B.11-27 10 H1_Day q80578pk + + - + + + + Ref MJJ-PK-01-012-11 Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
26 12:37:11 20250729-1142-B400_B.11-26 10 H1_Day q80578pk + + - + + + + Ref MJJ-PK-01-012-10 Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
25 12:34:05 20250729-1142-B400_B.11-25 10 H1_Day q80578pk + + - + + + + Ref MJJ-PK-01-012-9 Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
24 12:30:51 20250729-1142-B400_B.11-24 10 H1_Day q80578pk + + - + + + + Ref MJJ-PK-01-012-8 Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
19 12:27:46 20250729-1136-B400_B.11-19 10 H1_Day q80578pk + + - + + + + Ref MJJ-PK-01-012-7 Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
18 12:24:40 20250729-1136-B400_B.11-18 10 H1_Day q80578pk + + - + + + + Ref MJJ-PK-01-012-6 Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
17 12:21:25 20250729-1136-B400_B.11-17 10 H1_Day q80578pk + + - + + + + Ref MJJ-PK-01-012-5 Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
15 12:16:49 20250729-1158-B400_B.11-15 10 H1_Day16 m14269jw + + - + + + + Ref IR-JW-AnthLigRecryst Group Riddell_I sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
14 12:14:09 20250729-1149-B400_B.11-14 12 P31_CPD_Day w52164bc - + - - - + + Ref BC-11-041 Group James_M sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0; pp: Cannot find any peak for scaling in /mnt/nmrdata/James_M/data/w52164bc/nmr/20250729-1149-B400_B.11-14/12/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/James_M/data/w52164bc/nmr/20250729-1149-B400_B.11-14/12/pdata/1/peaks!
14 12:12:00 20250729-1149-B400_B.11-14 11 F19_NoCPD_Day w52164bc - + - - - + + Ref BC-11-041 Group James_M 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 12:06:33 20250729-1149-B400_B.11-14 10 H1_Day16 w52164bc + + - + + + + Ref BC-11-041 Group James_M
13 11:58:41 20250729-1140-B400_B.11-13 10 H1_Day16 x06125gb + + - + + + + Ref GCGB253Cr Group Crisenza_G
11 11:54:59 20250729-1137-B400_B.11-11 10 H1_Day mbdxkrn2 + + - + + + + Ref endo-sd007 Group DeBo_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
10 11:51:53 20250729-1135-B400_B.11-10 10 H1_Day q80578pk + + - + + + + Ref MJJ-PK-01-012-4 Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
9 11:48:48 20250729-1135-B400_B.11-9 10 H1_Day q80578pk + + - + + + + Ref MJJ-PK-01-012-3 Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
8 11:45:36 20250729-1135-B400_B.11-8 10 H1_Day q80578pk + + - + + + + Ref MJJ-PK-01-012-2 Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
7 11:44:22 20250729-1130-B400_B.11-7 11 H1_Day q80578pk - + - - - + + Ref MJJ-PK-01-012-1 Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
7 11:31:38 20250729-1130-B400_B.11-7 10 H1_Quant_D1_25s_Day q80578pk + + - + + + + Ref MJJ-PK-01-012-1 Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
16 11:22:22 20250729-1109-B400_B.11-16 13 H1_Night e14150oc - + - - - + + Ref DS003.1 Group Winpenny_R
16 11:16:29 20250729-1109-B400_B.11-16 12 H1_COSY_Day e14150oc - + - - - + + Ref DS003.1 Group Winpenny_R 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 11:14:28 20250729-1109-B400_B.11-16 11 C13_CPD_Day e14150oc - + - - - + + Ref DS003.1 Group Winpenny_R sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
16 11:10:55 20250729-1109-B400_B.11-16 10 H1_Day e14150oc + + - + + + + Ref DS003.1 Group Winpenny_R
1 10:56:31 20250729-1037-B400_B.11-1 10 H1_Night b72547am + + - + + + + Ref 4-223 FC Group Larrosa_I
10 10:52:07 20250729-1049-B400_B.11-10 10 H1_Day h27839ea + + - + + + + Ref Deacetylation thio Group Gardiner_J
9 10:46:46 20250729-1026-B400_B.11-8 20 H1_Day16 z40241jm + + - + + + + Ref DJP-JIM-7-044-1a Group Procter_D
8 10:41:41 20250729-1026-B400_B.11-8 10 H1_Day16 z40241jm + + - + + + + Ref DJP-JIM-7-042-1a Group Procter_D
7 10:36:07 20250729-1020-B400_B.11-7 10 H1_Day16 m14269jw + + - + + + + Ref IR-JW-3074-Control Group Riddell_I sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
6 10:28:22 20250729-1019-B400_B.11-6 10 H1_Day w33284ak + + - + + + + Ref arun-aaaa Group Romanov_A arun-aaa
5 10:24:13 20250729-1011-B400_B.11-5 10 H1_Day16 y37570lc + + - + + + + Ref lc613-3 Group DeBo_G
4 10:19:40 20250729-1011-B400_B.11-4 10 H1_Day16 y37570lc + + - + + + + Ref lc613-2 Group DeBo_G
3 10:14:37 20250729-1000-B400_B.11-3 10 H1_Day16 w52164bc + + - + + + + Ref BC-11-043 Group James_M
2 10:09:26 20250729-1000-B400_B.11-2 10 H1_Day16 w52164bc + + - + + + + Ref BC-11-042 Group James_M sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
1 10:07:18 20250729-0959-B400_B.11-1 11 F19_NoCPD_Day w52164bc - + - - - + + Ref BC-11-041 P1 Group James_M 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 10:02:14 20250729-0959-B400_B.11-1 10 H1_Day16 w52164bc + + - + + + + Ref BC-11-041 P1 Group James_M
59 09:00:01 20250728-1530-B400_B.11-59 10 H1_make_shim.icon service + + - + + + + Ref sucrose shim Group Service sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
36 07:34:44 20250729-0734-B400_B.11-36 10 H1_Day16 mbdxkrn2 + + - + + + + Ref GDB-RN1549 After 24h in acetone - Acetone-d6 Group DeBo_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
17 03:14:37 20250728-1818-B400_B.11-17 10 H1_Day m52750pm + + - + + + + Ref GCPM96cr Group Crisenza_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
15 03:01:10 20250728-1728-B400_B.11-15 14 H1_COSY_HiRes_Night w52164bc - + - - - + + Ref BC-11-039 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
15 02:45:48 20250728-1728-B400_B.11-15 13 H1_C13_HSQC_Night w52164bc - + - - - + + Ref BC-11-039 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
15 01:52:03 20250728-1728-B400_B.11-15 12 C13_CPD_Night1024 w52164bc - + - - - + + Ref BC-11-039 Group James_M sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
15 01:16:54 20250728-1728-B400_B.11-15 11 H1_C13_HMBC_Night w52164bc - + - - - + + Ref BC-11-039BC-11-039BC-11-039 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
15 01:08:45 20250728-1728-B400_B.11-15 10 H1_Night w52164bc + + - + + + + Ref BC-11-039 Group James_M sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
5 23:40:01 20250728-1640-B400_B.11-5 10 H1_Night1024 x25009jo + + - + + + + Ref GDB-JO-864-K1-M Group DeBo_G
4 22:10:52 20250728-1640-B400_B.11-4 10 H1_Night1024 x25009jo + + - + + + + Ref GDB-JO-864-K1-P Group DeBo_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
12 21:43:38 20250728-1623-B400_B.11-12 15 C13_DEPT135_Night z69889rb - + - - - + + Ref SE129B Group Crisenza_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
12 21:03:04 20250728-1623-B400_B.11-12 14 H1_C13_HMBC_Night z69889rb + + - + + + + Ref SE129B 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
36 20:50:14 20250728-0723-B400_B.11-36 15 H1_NOESY_Night mbdxkrn2 - + - - - + + Ref GDB-RN1549 Full Char - Acetone-d6 Group DeBo_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
36 20:36:47 20250728-0723-B400_B.11-36 14 H1_COSY_HiRes_Night mbdxkrn2 - + - - - + + Ref GDB-RN1549 Full Char - Acetone-d6 Group DeBo_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
36 20:21:26 20250728-0723-B400_B.11-36 13 H1_C13_HSQC_Night mbdxkrn2 - + - - - + + Ref GDB-RN1549 Full Char - Acetone-d6 Group DeBo_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
36 19:43:36 20250728-0723-B400_B.11-36 12 H1_C13_HMBC_Night mbdxkrn2 + + - + + + + Ref GDB-RN1549 Full Char - Acetone-d6 Group DeBo_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 19:16:21 20250728-1624-B400_B.11-13 15 C13_DEPT135_Night z69889rb - + - - - + + Ref SE131B Group Crisenza_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
13 18:37:38 20250728-1624-B400_B.11-13 14 H1_C13_HMBC_Night z69889rb + + - + + + + Ref SE131B 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
14 18:23:25 20250728-1814-B400_B.11-14 10 H1_Night128 m09677nb + + - + + + + Ref 260 Group Greaney_M
13 18:08:03 20250728-1624-B400_B.11-13 13 H1_C13_HSQC_Night z69889rb - + - - - + + Ref SE131B 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
13 17:54:36 20250728-1624-B400_B.11-13 12 H1_COSY_HiRes_Night z69889rb - + - - - + + Ref SE131B 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
13 17:37:05 20250728-1624-B400_B.11-13 11 C13_CPD_Night256 z69889rb + + - + + + + Ref SE131B Group Crisenza_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
16 17:32:25 20250728-1729-B400_B.11-16 10 H1_Night x25009jo + + - + + + + Ref GDB-JO-822-proton Group DeBo_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
13 17:27:18 20250728-1624-B400_B.11-13 10 H1_Night z69889rb + + - + + + + Ref SE131B Group Crisenza_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
12 17:11:57 20250728-1623-B400_B.11-12 13 H1_C13_HSQC_Night z69889rb - + - - - + + Ref SE129B 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
12 16:58:30 20250728-1623-B400_B.11-12 12 H1_COSY_HiRes_Night z69889rb - + - - - + + Ref SE129B 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
12 16:40:58 20250728-1623-B400_B.11-12 11 C13_CPD_Night256 z69889rb + + - + + + + Ref SE129B Group Crisenza_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
15 16:34:29 20250728-1628-B400_B.11-15 10 H1_Day16 mbdxkrn2 + + - + + + + Ref GDB-RN1273 Pure crystals after 2 months under high vac - Basic CDCl3 Group DeBo_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
14 16:30:41 20250728-1624-B400_B.11-14 10 H1_Day z69889rb + + - + + + + Ref SE132 Group Crisenza_G
12 16:23:59 20250728-1623-B400_B.11-12 10 H1_Night z69889rb + + - + + + + Ref SE129B Group Crisenza_G
9 15:49:55 20250728-1545-B400_B.11-9 10 H1_Day16 y37570lc + + - + + + + Ref lc613-3 Group DeBo_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
8 15:45:24 20250728-1545-B400_B.11-8 10 H1_Day16 y37570lc + + - + + + + Ref lc613-2 Group DeBo_G
3 15:39:33 20250728-1531-B400_B.11-3 11 F19_NoCPD_Day mbdxrbj2 - + - - - + + Ref BJ552 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
3 15:35:57 20250728-1531-B400_B.11-3 10 H1_Day mbdxrbj2 + + - + + + + Ref BJ552 Group Procter_D sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
2 15:34:02 20250728-1513-B400_B.11-2 11 C13_CPD_Day m90460ad - + - - - + + Ref mfg-ad-423b Group Greaney_M sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
2 15:27:34 20250728-1513-B400_B.11-2 10 H1_Day m90460ad + + - + + + + Ref mfg-ad-423b Group Greaney_M
1 15:24:59 20250728-1513-B400_B.11-1 11 C13_CPD_Day m90460ad - + - - - + + Ref mfg-ad-423a Group Greaney_M sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
1 15:19:27 20250728-1513-B400_B.11-1 10 H1_Day m90460ad + + - + + + + Ref mfg-ad-423a Group Greaney_M
41 15:17:15 20250728-1040-B400_B.11-41 11 P31_Wide_Day b36621hr - + - - - + + Ref DPM-HR192-[YPtt3] Group Mills_D pp: Cannot find any peak for scaling in /mnt/nmrdata/Mills_D/data/b36621hr/nmr/20250728-1040-B400_B.11-41/11/pdata/1/peaks!, pp: Cannot find any peak for scaling in /mnt/nmrdata/Mills_D/data/b36621hr/nmr/20250728-1040-B400_B.11-41/11/pdata/1/peaks!
41 10:42:12 20250728-1040-B400_B.11-41 10 P31_Wide_Day b36621hr + + - + + + + Ref DPM-HR192-[YPtt3] Group Mills_D
36 08:20:17 20250728-0723-B400_B.11-36 11 H1_Night mbdxkrn2 - + - - - + + Ref GDB-RN1549 Full Char - Acetone-d6 Group DeBo_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
36 07:24:07 20250728-0723-B400_B.11-36 10 C13_CPD_Night1024 mbdxkrn2 + + - + + + + Ref GDB-RN1549 Full Char - Acetone-d6 Group DeBo_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
52 20:33:48 20250726-2033-B400_B.11-52 10 H1_Day16 y52364mw + + - + + + + Ref GDB-MJ-144-P2 Group DeBo_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
51 18:30:47 20250726-1829-B400_B.11-51 10 H1_Day16 y52364mw + + - + + + + Ref GDB-MJ-144-P1 Group DeBo_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
15 05:50:33 20250725-1821-B400_B.11-15 11 C13_CPD_Night1024 z69889rb - + - - - + + Ref SE131B Group Crisenza_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
15 05:45:00 20250725-1821-B400_B.11-15 10 H1_Night z69889rb + + - + + + + Ref SE131B Group Crisenza_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
14 04:51:13 20250725-1820-B400_B.11-14 11 C13_CPD_Night1024 z69889rb - + - - - + + Ref SE129B Group Crisenza_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
14 04:46:08 20250725-1820-B400_B.11-14 10 H1_Night z69889rb + + - + + + + Ref SE129B Group Crisenza_G
50 04:16:19 20250725-1441-B400_B.11-50 10 C13_DEPT135_Night h91839em + + - + + + + Ref gc em 67 f2 Group Crisenza_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
44 04:02:51 20250725-1354-B400_B.11-44 14 H1_COSY_HiRes_Night mbdxkrn2 - + - - - + + Ref SD006-exo Full Char Group DeBo_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
44 03:47:29 20250725-1354-B400_B.11-44 13 H1_C13_HSQC_Night mbdxkrn2 - + - - - + + Ref SD006-exo Full Char Group DeBo_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
44 03:12:20 20250725-1354-B400_B.11-44 12 H1_C13_HMBC_Night mbdxkrn2 - + - - - + + Ref SD006-exo Full Char Group DeBo_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
44 03:10:01 20250725-1354-B400_B.11-44 11 H1_Night mbdxkrn2 - + - - - + + Ref SD006-exo Full Char Group DeBo_G
44 02:39:41 20250725-1354-B400_B.11-44 10 C13_CPD_Night256 mbdxkrn2 + + - + + + + Ref SD006-exo Full Char Group DeBo_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
43 02:26:13 20250725-1353-B400_B.11-43 14 H1_COSY_HiRes_Night mbdxkrn2 - + - - - + + Ref SD006-endo Full Char Group DeBo_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
43 02:10:52 20250725-1353-B400_B.11-43 13 H1_C13_HSQC_Night mbdxkrn2 - + - - - + + Ref SD006-endo Full Char Group DeBo_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
43 01:35:43 20250725-1353-B400_B.11-43 12 H1_C13_HMBC_Night mbdxkrn2 - + - - - + + Ref SD006-endo Full Char Group DeBo_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
43 01:33:24 20250725-1353-B400_B.11-43 11 H1_Night mbdxkrn2 - + - - - + + Ref SD006-endo Full Char Group DeBo_G
43 01:01:01 20250725-1353-B400_B.11-43 10 C13_CPD_Night256 mbdxkrn2 + + - + + + + Ref SD006-endo Full Char Group DeBo_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
34 23:31:44 20250725-1114-B400_B.11-34 10 H1_Night1024 x25009jo + + - + + + + Ref GDB-JO-864-K1-M Group DeBo_G
51 23:25:12 20250725-2218-B400_B.11-51 10 H1_Night y52364mw + + - + + + + Ref GDB-MJ-144R Group DeBo_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
33 21:56:33 20250725-1114-B400_B.11-33 10 H1_Night1024 x25009jo + + - + + + + Ref GDB-JO-864-K1P Group DeBo_G
32 20:28:02 20250725-1114-B400_B.11-32 10 H1_Night1024 x25009jo + + - + + + + Ref GDB-JO-851-K2-PSNW Group DeBo_G
31 18:59:09 20250725-1114-B400_B.11-31 10 H1_Night1024 x25009jo + + - + + + + Ref GDB-JO-851-K1PSNW Group DeBo_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
19 17:30:12 20250724-1738-B400_B.11-19 10 H1_Night1024 y37570lc + + - + + + + Ref gdb-rs103-1 (rs-69) Group DeBo_G
10 17:12:02 20250725-1636-B400_B.11-10 12 F19_NoCPD_Day c46714th - + - - - + + Ref TH-607-009-solids again Group James_M 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 17:06:49 20250725-1636-B400_B.11-10 11 H1_Day16 c46714th + + - + x + + Ref TH-607-009-solids again Group James_M topshim: TopshimFieldMap - no valid data in sample centre, Shim failed
10 16:43:20 20250725-1636-B400_B.11-10 10 H1_Day q80578pk + + - + + + + Ref MJJ-PK-01-010-2eq-6h-0C Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
9 16:40:13 20250725-1636-B400_B.11-9 10 H1_Day q80578pk + + - + + + + Ref MJJ-PK-01-010-1eq-6h-0C Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
8 16:37:09 20250725-1636-B400_B.11-8 10 H1_Day q80578pk + + - + + + + Ref MJJ-PK-01-010-0.5eq-6h-0C Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
13 16:31:40 20250725-1627-B400_B.11-13 10 H1_Day q80578pk + + - + + + + Ref MJJ-PK-01-010-1-r-new Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
12 16:29:45 20250725-1616-B400_B.11-12 11 P31_Wide_Day b36621hr - + - - - + + Ref DPM-HR192-[YPtt3] Group Mills_D pp: Cannot find any peak for scaling in /mnt/nmrdata/Mills_D/data/b36621hr/nmr/20250725-1616-B400_B.11-12/11/pdata/1/peaks!, pp: Cannot find any peak for scaling in /mnt/nmrdata/Mills_D/data/b36621hr/nmr/20250725-1616-B400_B.11-12/11/pdata/1/peaks!
12 16:26:14 20250725-1616-B400_B.11-12 10 P31_Wide_Day b36621hr + + - + + + + Ref DPM-HR192-[YPtt3] Group Mills_D
11 16:18:51 20250725-1610-B400_B.11-11 10 H1_Day16 y52364mw + + - + + + + Ref GDB-MJ-143 Group DeBo_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
8 16:06:36 20250725-1556-B400_B.11-8 11 H1_Quant_D1_25s_Day q80578pk + + - + + + + Ref MJJ-PK-01-010-0.5eq-6h-0C Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
10 16:03:30 20250725-1557-B400_B.11-10 10 H1_Day q80578pk + + - + + + + Ref MJJ-PK-01-010-2eq-6h-0C Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
9 16:00:23 20250725-1557-B400_B.11-9 10 H1_Day q80578pk + + - + + + + Ref MJJ-PK-01-010-1eq-6h-0C Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
8 15:57:15 20250725-1556-B400_B.11-8 10 H1_Day q80578pk + + - + + + + Ref MJJ-PK-01-010-0.5eq-6h-0C Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
5 15:25:35 20250725-1524-B400_B.11-5 10 H1_Quant_D1_25s_Day q80578pk + + - + + + + Ref MJJ-PK-01-010-dmso-r Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
4 15:11:05 20250725-1510-B400_B.11-4 10 H1_Quant_D1_25s_Day q80578pk + + - + + + + Ref MJJ-PK-01-010-1-0C-0.5eq-q Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
2 15:01:05 20250725-1450-B400_B.11-2 11 F19_NoCPD_Day mbdxrbj2 - + - - - + + Ref BJ549_PC 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
2 14:57:19 20250725-1450-B400_B.11-2 10 H1_Day mbdxrbj2 + + - + + + + Ref BJ549_PC Group Procter_D sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
1 14:55:18 20250725-1450-B400_B.11-1 11 F19_NoCPD_Day mbdxrbj2 - + - - - + + Ref BJ546_PC 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
1 14:51:27 20250725-1450-B400_B.11-1 10 H1_Day mbdxrbj2 + + - + x + + Ref BJ546_PC Group Procter_D topshim: TopshimFieldMap - no valid data in sample centre, Shim failed, sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
5 14:29:39 20250725-1429-B400_B.11-5 10 Si29_DEPT90_Day e47904lh + + - + + + + Ref 3 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/e47904lh/nmr/20250725-1429-B400_B.11-5/10/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/e47904lh/nmr/20250725-1429-B400_B.11-5/10/pdata/1/peaks!
18 14:13:26 20250725-1404-B400_B.11-18 10 H1_Day x06125gb + + - + + + + Ref GCGB252F23-33 Group Crisenza_G
17 14:07:31 20250725-1356-B400_B.11-17 10 H1_Day16 m09677nb + + - + + + + Ref py cf3 Group Greaney_M
16 14:02:03 20250725-1355-B400_B.11-16 10 H1_Day16 m09677nb + + - + + + + Ref 4ph py Group Greaney_M
15 13:59:46 20250725-1352-B400_B.11-15 11 F19_NoCPD_Day w52164bc - + - - - + + Ref BC-11-039 Group James_M 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 13:53:27 20250725-1352-B400_B.11-15 10 H1_Day16 w52164bc + + - + + + + Ref BC-11-039 Group James_M sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
17 13:32:40 20250725-1150-B400_B.11-17 10 H1_Day16 f85241bm + + - + x + + Ref BM940-22 Group Bures_J topshim: TopshimFieldMap - no valid data in sample centre, Shim failed
15 13:30:40 20250725-1317-B400_B.11-15 11 P31_Wide_Day b36621hr - + - - - + + Ref HR192-[YPtt] 24 hours Group Mills_D pp: Cannot find any peak for scaling in /mnt/nmrdata/Mills_D/data/b36621hr/nmr/20250725-1317-B400_B.11-15/11/pdata/1/peaks!, pp: Cannot find any peak for scaling in /mnt/nmrdata/Mills_D/data/b36621hr/nmr/20250725-1317-B400_B.11-15/11/pdata/1/peaks!
15 13:27:14 20250725-1317-B400_B.11-15 10 P31_Wide_Day b36621hr + + - + + + + Ref HR192-[YPtt] 24 hours Group Mills_D
14 13:23:52 20250725-1219-B400_B.11-14 10 H1_ExtraWide_Day mbgnrjs3 + + - + + + + Ref STL-JS- Mg anthracene Group Liddle_S sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
13 13:17:58 20250725-1149-B400_B.11-11 30 H1_Day16 f85241bm + + - + + + + Ref BM940-21 Group Bures_J
12 13:12:23 20250725-1149-B400_B.11-11 20 H1_Day16 f85241bm + + - + + + + Ref BM940-20 Group Bures_J
11 13:05:05 20250725-1149-B400_B.11-11 10 H1_Day16 f85241bm + + - + + + + Ref BM940-19 Group Bures_J
10 12:52:56 20250725-1119-B400_B.11-10 10 H1_Quant_D1_25s_Day q80578pk + + - + + + + Ref MJJ-PK-01-010-DMSO-R Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
9 12:40:31 20250725-1118-B400_B.11-9 10 H1_Quant_D1_25s_Day q80578pk + + - + + + + Ref MJJ-PK-01-010-0-R Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
8 12:27:51 20250725-1118-B400_B.11-8 10 H1_Quant_D1_25s_Day q80578pk + + - + + + + Ref MJJ-PK-01-010-9-R Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
7 12:23:44 20250725-1218-B400_B.11-7 10 H1_ExtraWide_Day mbgnrjs3 + + - + + + + Ref STL-JS - I3 (dioxane)1.5 Group Liddle_S sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
6 12:18:49 20250725-1146-B400_B.11-4 30 H1_Day16 f85241bm + + - + x + + Ref BM940-18 Group Bures_J topshim: TopshimFieldMap - no valid data in sample centre, Shim failed
5 12:13:30 20250725-1146-B400_B.11-4 20 H1_Day16 f85241bm + + - + + + + Ref BM940-17 Group Bures_J
4 12:08:09 20250725-1146-B400_B.11-4 10 H1_Day16 f85241bm + + - + x + + Ref BM940-16 Group Bures_J topshim: TopshimFieldMap - no valid data in sample centre, Shim failed
3 11:56:02 20250725-1118-B400_B.11-3 10 H1_Quant_D1_25s_Day q80578pk + + - + + + + Ref MJJ-PK-01-010-5-R Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
2 11:43:56 20250725-1117-B400_B.11-2 10 H1_Quant_D1_25s_Day q80578pk + + - + + + + Ref MJJ-PK-01-010-3-R Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
1 11:31:10 20250725-1117-B400_B.11-1 10 H1_Quant_D1_25s_Day q80578pk + + - + + + + Ref MJJ-PK-01-010-1-R Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
60 11:27:51 20250725-1119-B400_B.11-60 10 H1_Day j20588jh + + - + + + + Ref JH-DW-26.22.1-DippZnAlCl TMSN3 styrene Group Willcox_D Onight rt
59 11:23:03 20250725-1108-B400_B.11-57 30 H1_Day16 z40241jm + + - + x + + Ref DJP-JIM-7-043-1a Group Procter_D topshim: TopshimFieldMap - no valid data in sample centre, Shim failed, sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
58 11:18:11 20250725-1108-B400_B.11-57 20 H1_Day16 z40241jm + + - + x + + Ref DJP-JIM-7-042-1a Group Procter_D topshim: TopshimFieldMap - no valid data in sample centre, Shim failed, sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
57 11:12:23 20250725-1108-B400_B.11-57 10 H1_Day16 z40241jm + + - + + + + Ref DJP-JIM-7-019-1b Group Procter_D
56 11:07:35 20250725-1106-B400_B.11-56 10 H1_Day16 h91839em + + - + x + + Ref GC EM 68 C Group Crisenza_G topshim: TopshimFieldMap - no valid data in sample centre, Shim failed, sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
46 10:50:19 20250725-1042-B400_B.11-46 10 H1_Day w12998gm + + - + x + + Ref il-gm8-088-2 Group Larrosa_I topshim: TopshimFieldMap - no valid data in sample centre, Shim failed, sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
45 10:45:34 20250725-1040-B400_B.11-45 10 H1_Day16 y38246dt + + - + + + + Ref GDB-DT-926-Cr Group DeBo_G GDB-DT-926-Cr sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
44 10:43:38 20250725-1038-B400_B.11-44 11 P31_Wide_Day b36621hr - + - - - + + Ref HR191-[YPtt3] hex/tol 18 hours Group Mills_D pp: Cannot find any peak for scaling in /mnt/nmrdata/Mills_D/data/b36621hr/nmr/20250725-1038-B400_B.11-44/11/pdata/1/peaks!, pp: Cannot find any peak for scaling in /mnt/nmrdata/Mills_D/data/b36621hr/nmr/20250725-1038-B400_B.11-44/11/pdata/1/peaks!
44 10:40:06 20250725-1038-B400_B.11-44 10 P31_Wide_Day b36621hr + + - + + + + Ref HR191-[YPtt3] hex/tol 18 hours Group Mills_D
42 10:17:25 20250725-1002-B400_B.11-42 10 H1_Day c46714th + + - + + + + Ref TH-618-001-rm Group James_M sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
41 10:13:20 20250725-1002-B400_B.11-41 10 H1_Day c46714th + + - + + + + Ref TH-617-001-rm Group James_M sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
36 10:09:37 20250725-1001-B400_B.11-36 10 H1_Day c46714th + + - + + + + Ref TH-616-001-rm Group James_M sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
35 10:06:25 20250725-1001-B400_B.11-35 10 H1_Day c46714th + + - + + + + Ref TH-615-001-rm Group James_M sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
34 10:01:43 20250725-1000-B400_B.11-34 10 H1_Day c46714th + + - + + + + Ref TH-614-001-rm Group James_M sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
18 07:57:09 20250724-1554-B400_B.11-18 14 F19_NoCPD_Day m69065je - + - - - + + Ref JEK601_htd80_t48 Group Mills_D JEK601_htd80_t48 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 'capillary_C6D6' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'capillary_C6D6' SR is set to 0.0
18 07:43:38 20250724-1554-B400_B.11-18 13 H1_COSY_HiRes_Night m69065je - + - - - + + Ref JEK601_htd80_t48 Group Mills_D JEK601_htd80_t48 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
18 07:12:52 20250724-1554-B400_B.11-18 12 H1_Si29_HMBC_Night m69065je - + - - - + + Ref JEK601_htd80_t48 Group Mills_D JEK601_htd80_t48 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
18 06:18:59 20250724-1554-B400_B.11-18 11 Si29_DEPT90_Night m69065je - + - - - + + Ref JEK601_htd80_t48 Group Mills_D JEK601_htd80_t48 sref: NUCLEUS '29Si' not defined for SOLVENT 'capillary_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/20250724-1554-B400_B.11-18/11/pdata/1/peaks!, sref: NUCLEUS '29Si' not defined for SOLVENT 'capillary_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/20250724-1554-B400_B.11-18/11/pdata/1/peaks!
18 06:14:38 20250724-1554-B400_B.11-18 10 H1_Night m69065je + + - + + + + Ref JEK601_htd80_t48 Group Mills_D JEK601_htd80_t48 pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Mills_D/data/m69065je/nmr/20250724-1554-B400_B.11-18/10/pdata/1/peaks!, pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Mills_D/data/m69065je/nmr/20250724-1554-B400_B.11-18/10/pdata/1/peaks!
17 06:13:09 20250724-1553-B400_B.11-17 14 B11_NoCPD_Day m69065je - + - - - + + Ref JEK600_htd80_t48 Group Mills_D JEK600_htd80_t48 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/20250724-1553-B400_B.11-17/14/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/20250724-1553-B400_B.11-17/14/pdata/1/peaks!
17 05:59:36 20250724-1553-B400_B.11-17 13 H1_COSY_HiRes_Night m69065je - + - - - + + Ref JEK600_htd80_t48 Group Mills_D JEK600_htd80_t48 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
17 05:28:55 20250724-1553-B400_B.11-17 12 H1_Si29_HMBC_Night m69065je - + - - - + + Ref JEK600_htd80_t48 Group Mills_D JEK600_htd80_t48 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
17 04:34:47 20250724-1553-B400_B.11-17 11 Si29_DEPT90_Night m69065je - + - - - + + Ref JEK600_htd80_t48 Group Mills_D JEK600_htd80_t48 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/20250724-1553-B400_B.11-17/11/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/m69065je/nmr/20250724-1553-B400_B.11-17/11/pdata/1/peaks!
17 04:30:18 20250724-1553-B400_B.11-17 10 H1_Night m69065je + + - + + + + Ref JEK600_htd80_t48 Group Mills_D JEK600_htd80_t48
45 03:32:43 20250724-1206-B400_B.11-45 10 C13_CPD_Night1024 z65435tw + + - + + + + Ref GC-EJ-16c Group Crisenza_G
44 03:30:30 20250723-1523-B400_B.11-44 12 H1_Day16 z65435tw - + - - - + + Ref gc-ej-18-p-1h-cdcl3 Group Crisenza_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
44 03:18:49 20250723-1523-B400_B.11-44 13 H1_Night128 z65435tw - + - - - + + Ref gc-ej-18-p-1h-cdcl3 Group Crisenza_G
44 02:21:49 20250723-1523-B400_B.11-44 11 C13_CPD_Night1024 z65435tw + + - + + + + Ref gc-ej-18-p-13c-cdcl3 Group Crisenza_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
52 01:25:11 20250723-1707-B400_B.11-51 22 C13_CPD_Night1024 m09677nb + + - + + + + Ref carbazole cf3 Group Greaney_M sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
51 00:26:18 20250723-1707-B400_B.11-51 12 C13_CPD_Night1024 m09677nb + + - + + + + Ref furan cf3 Group Greaney_M sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
60 22:57:50 20250723-1615-B400_B.11-60 10 H1_Night1024 x25009jo + + - + + + + Ref GDB-JO-864-K3-PNW Group DeBo_G
59 21:29:10 20250723-1615-B400_B.11-59 10 H1_Night1024 x25009jo + + - + + + + Ref GDB-JO-864-K2-PNW Group DeBo_G
37 21:29:00 20250723-1519-B400_B.11-37 17 F19_NoCPD_Night mbdxkrn2 - x - - - - - Ref GDB-RN1548(ii) Full Char - Acetone-d6 Group DeBo_G ATMA Select Nucleus failed, ATM Failed
37 21:16:10 20250723-1519-B400_B.11-37 16 H1_NOESY_Night mbdxkrn2 - + - - - + + Ref GDB-RN1548(ii) Full Char - Acetone-d6 Group DeBo_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
37 21:02:37 20250723-1519-B400_B.11-37 15 H1_COSY_HiRes_Night mbdxkrn2 - + - - - + + Ref GDB-RN1548(ii) Full Char - Acetone-d6 Group DeBo_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
37 20:47:15 20250723-1519-B400_B.11-37 14 H1_C13_HSQC_Night mbdxkrn2 - + - - - + + Ref GDB-RN1548(ii) Full Char - Acetone-d6 Group DeBo_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
37 20:12:06 20250723-1519-B400_B.11-37 13 H1_C13_HMBC_Night mbdxkrn2 - + - - - + + Ref GDB-RN1548(ii) Full Char - Acetone-d6 Group DeBo_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
37 20:09:52 20250723-1519-B400_B.11-37 12 H1_Night mbdxkrn2 - + - - - + + Ref GDB-RN1548(ii) Full Char - Acetone-d6 Group DeBo_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
37 19:13:46 20250723-1519-B400_B.11-37 11 C13_CPD_Night1024 mbdxkrn2 + + - + + + + Ref GDB-RN1548(ii) Full Char - Acetone-d6 Group DeBo_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
28 18:17:18 20250723-1424-B400_B.11-28 10 C13_CPD_Night1024 w12998gm + + - + + + + Ref il-gm-8-087-crude Group Larrosa_I sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
41 18:15:25 20250722-1923-B400_B.11-41 13 F19_NoCPD_Day p16600hw - + - - - + + Ref mfg-whw20250723-1 Group Greaney_M 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
41 17:45:12 20250722-1923-B400_B.11-41 12 C13_DEPT135_Night p16600hw + + - + + + + Ref mfg-whw20250723-1 Group Greaney_M sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
13 17:27:22 20250724-1517-B400_B.11-13 11 C13_CPD_Night256 z69889rb + + - + + + + Ref SE130B Group Crisenza_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
5 17:13:53 20250724-1307-B400_B.11-5 11 H1_COSY_HiRes_Night y52364mw - + - - - + + Ref GDB-HW-8-COSY Group DeBo_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 17:07:16 20250724-1307-B400_B.11-5 10 H1_Night y52364mw + + - + + + + Ref GDB-HW-8-COSY Group DeBo_G
4 16:50:43 20250724-1306-B400_B.11-4 12 H1_COSY_HiRes_Night y52364mw + + - + + + + Ref GDB-HW-7-COSY Group DeBo_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 16:46:27 20250724-1622-B400_B.11-27 10 H1_Day16 mbdxkrn2 + + - + + + + Ref GDB-RN1549 Column Fraction 14 - Acetone-d6 Group DeBo_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
26 16:41:40 20250724-1622-B400_B.11-26 10 H1_Day16 mbdxkrn2 + + - + + + + Ref GDB-RN1549 Column Fraction 13 - Acetone-d6 Group DeBo_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
25 16:36:50 20250724-1621-B400_B.11-25 10 H1_Day mbdxkrn2 + + - + + + + Ref sd006-good Group DeBo_G
24 16:31:27 20250724-1620-B400_B.11-24 10 H1_Day mbdxkrn2 + + - + + + + Ref sd006-bad Group DeBo_G
23 16:29:20 20250724-1605-B400_B.11-23 14 F19_NoCPD_Day r57145lg - + - - - + + Ref capg_LPG074_test 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!
23 16:27:19 20250724-1605-B400_B.11-23 13 B11_CPD_Day r57145lg - + - - - + + Ref capg_LPG074_test Group Goodwin_C pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Goodwin_C/data/r57145lg/nmr/20250724-1605-B400_B.11-23/13/pdata/1/peaks!, pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Goodwin_C/data/r57145lg/nmr/20250724-1605-B400_B.11-23/13/pdata/1/peaks!
23 16:26:27 20250724-1605-B400_B.11-23 12 H1_ExtraWide_Day r57145lg - + - - - + + Ref capg_LPG074_test Group Goodwin_C pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Goodwin_C/data/r57145lg/nmr/20250724-1605-B400_B.11-23/12/pdata/1/peaks!, pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Goodwin_C/data/r57145lg/nmr/20250724-1605-B400_B.11-23/12/pdata/1/peaks!
23 16:25:02 20250724-1605-B400_B.11-23 11 H1_Wide_Day r57145lg - + - - - + + Ref capg_LPG074_test Group Goodwin_C pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Goodwin_C/data/r57145lg/nmr/20250724-1605-B400_B.11-23/11/pdata/1/peaks!, pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Goodwin_C/data/r57145lg/nmr/20250724-1605-B400_B.11-23/11/pdata/1/peaks!
23 16:21:35 20250724-1605-B400_B.11-23 10 H1_Day16 r57145lg + + - + + + + Ref capg_LPG074_test Group Goodwin_C pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Goodwin_C/data/r57145lg/nmr/20250724-1605-B400_B.11-23/10/pdata/1/peaks!, pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Goodwin_C/data/r57145lg/nmr/20250724-1605-B400_B.11-23/10/pdata/1/peaks!
22 16:18:30 20250724-1603-B400_B.11-22 10 H1_Day q62112nk + + - + + + + Ref djp-nk-1-171-B Group Procter_D sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
21 16:14:56 20250724-1603-B400_B.11-21 10 H1_Day q62112nk + + - + + + + Ref djp-nk-1-171a Group Procter_D sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
20 16:10:23 20250724-1602-B400_B.11-20 10 H1_Day16 mbdxkrn2 + + - + + + + Ref GDB-RN1549 Column Fraction 12 - Acetone-d6 Group DeBo_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
19 16:05:33 20250724-1601-B400_B.11-19 10 H1_Day16 mbdxkrn2 + + - + + + + Ref GDB-RN1549 Column Fraction 11 - Acetone-d6 Group DeBo_G
16 16:00:47 20250724-1541-B400_B.11-16 10 H1_Day16 h91839em + + - + + + + Ref GC EM 67 F2 Group Crisenza_G
15 15:54:57 20250724-1541-B400_B.11-15 10 H1_Day16 h91839em + + - + + + + Ref GC EM 67 F1 Group Crisenza_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
14 15:49:10 20250724-1540-B400_B.11-14 10 H1_Day16 h91839em + + - + + + + Ref GC EM 65 C Group Crisenza_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
13 15:45:52 20250724-1517-B400_B.11-13 10 H1_Day z69889rb + + - + + + + Ref SE130B Group Crisenza_G
12 15:35:20 20250724-1510-B400_B.11-12 10 H1_Day16 mbdxkrn2 + + - + + + + Ref GDB-RN1525-3 Et2O-precipitated polymer - Basic CDCl3 Group DeBo_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
11 15:31:00 20250724-1510-B400_B.11-11 10 H1_Day16 mbdxkrn2 + + - + + + + Ref GDB-RN1549 Column Fraction 10 - Acetone-d6 Group DeBo_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
10 15:26:01 20250724-1510-B400_B.11-10 10 H1_Day16 mbdxkrn2 + + - + + + + Ref GDB-RN1549 Column Fraction 9 - Acetone-d6 Group DeBo_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
9 15:20:11 20250724-1438-B400_B.11-9 14 H1_COSY_Day e47904lh - + - - - + + Ref 3 Group Mills_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
9 15:17:05 20250724-1438-B400_B.11-9 13 Si29_CPD_Day e47904lh - + - - - + + Ref 3 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/e47904lh/nmr/20250724-1438-B400_B.11-9/13/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/e47904lh/nmr/20250724-1438-B400_B.11-9/13/pdata/1/peaks!
9 15:15:46 20250724-1438-B400_B.11-9 12 H1_Day e47904lh - + - - - + + Ref 3 Group Mills_D
9 15:14:24 20250724-1438-B400_B.11-9 11 B11_NoCPD_Day e47904lh - + - - - + + Ref 3 Group Mills_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/Mills_D/data/e47904lh/nmr/20250724-1438-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/e47904lh/nmr/20250724-1438-B400_B.11-9/11/pdata/1/peaks!
9 15:10:10 20250724-1438-B400_B.11-9 10 H1_Day16 e47904lh + + - + + + + Ref 3 Group Mills_D
8 15:04:19 20250724-1438-B400_B.11-8 13 H1_COSY_Day e47904lh - + - - - + + Ref 2 Group Mills_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
8 15:02:56 20250724-1438-B400_B.11-8 12 H1_Day e47904lh - + - - - + + Ref 2 Group Mills_D
8 15:01:32 20250724-1438-B400_B.11-8 11 B11_NoCPD_Day e47904lh - + - - - + + Ref 2 Group Mills_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/Mills_D/data/e47904lh/nmr/20250724-1438-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/e47904lh/nmr/20250724-1438-B400_B.11-8/11/pdata/1/peaks!
8 14:57:13 20250724-1438-B400_B.11-8 10 H1_Day16 e47904lh + + - + + + + Ref 2 Group Mills_D
7 14:51:23 20250724-1438-B400_B.11-7 13 H1_COSY_Day e47904lh - + - - - + + Ref 1 Group Mills_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
7 14:49:59 20250724-1438-B400_B.11-7 12 H1_Day e47904lh - + - - - + + Ref 1 Group Mills_D sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
7 14:48:02 20250724-1438-B400_B.11-7 11 B11_NoCPD_Day e47904lh - + - - - + + Ref 1 Group Mills_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/Mills_D/data/e47904lh/nmr/20250724-1438-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/e47904lh/nmr/20250724-1438-B400_B.11-7/11/pdata/1/peaks!
7 14:43:18 20250724-1438-B400_B.11-7 10 H1_Day16 e47904lh + + - + + + + Ref 1 Group Mills_D sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
6 14:39:34 20250724-1435-B400_B.11-6 10 H1_Day u67812sg + + - + + + + Ref sq-01-135-1 Group Procter_D
4 14:34:12 20250724-1306-B400_B.11-4 11 H1_Night y52364mw + + - + + + + Ref GDB-HW-7-COSY Group DeBo_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
3 14:20:42 20250724-1305-B400_B.11-3 12 H1_COSY_HiRes_Night y52364mw - + - - - + + Ref GDB-HW-7-P2 Group DeBo_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
3 13:41:16 20250724-1305-B400_B.11-3 12 H1_COSY_HiRes_Night y52364mw - + - - - + + Ref GDB-HW-7-P2 Group DeBo_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
3 13:35:50 20250724-1305-B400_B.11-3 11 H1_Night y52364mw + + - + + + + Ref GDB-HW-7-P2 Group DeBo_G
1 13:22:24 20250724-1302-B400_B.11-1 12 H1_COSY_HiRes_Night y52364mw - + - - - + + Ref GDB-HW-7-P1 Group DeBo_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 13:17:16 20250724-1302-B400_B.11-1 11 H1_Night y52364mw + + - + + + + Ref GDB-HW-7-P1 Group DeBo_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
3 13:10:54 20250724-1305-B400_B.11-3 10 H1_Day16 y52364mw + + - + + + + Ref GDB-HW-7-P2 Group DeBo_G
1 13:05:44 20250724-1302-B400_B.11-1 10 H1_Day16 y52364mw + + - + + + + Ref GDB-HW-7-P1 Group DeBo_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
58 13:02:02 20250724-1301-B400_B.11-58 10 H1_Day j20588jh + + - + + + + Ref JH-DW-26.22.1-DippZnAlCl TMSN3 Styrene Group Willcox_D 1hr after addn
57 12:41:44 20250724-1237-B400_B.11-53 20 H1_Day16 f85241bm + + - + + + + Ref BM937-4 Group Bures_J
53 12:38:14 20250724-1237-B400_B.11-53 10 H1_Day16 f85241bm + + - x - - - Ref BM937-4 Group Bures_J Lock failed after multiple attempts, lock: Command 'lock CDCl3' failed. Lock is OFF, Command 'lock CDCl3' failed. Lock is OFF
49 12:16:20 20250724-1208-B400_B.11-49 10 H1_Day16 m09677nb + + - + + + + Ref dbt zk Group Greaney_M
48 12:13:11 20250724-1207-B400_B.11-48 10 H1_Day j20588jh + + - + + + + Ref JH-DW-26.22.1-DippZnAlCl TMSN3 Styrene Group Willcox_D After addn
47 12:09:51 20250724-1207-B400_B.11-47 10 H1_Day j20588jh + + - + + + + Ref JH-DW-26.08.2-DippZnAlCl TMSN3 Group Willcox_D Hex filt
46 12:06:29 20250724-1206-B400_B.11-46 10 H1_Day x06125gb + + - + + + + Ref GCGB252 Group Crisenza_G
56 11:34:57 20250724-1130-B400_B.11-56 11 C13_CPD_Day m64645hs - + - - - + + Ref oc_033_park2wrkup Group Natrajan_L pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Natrajan_L/data/m64645hs/nmr/20250724-1130-B400_B.11-56/11/pdata/1/peaks!, pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Natrajan_L/data/m64645hs/nmr/20250724-1130-B400_B.11-56/11/pdata/1/peaks!
56 11:32:33 20250724-1130-B400_B.11-56 10 H1_Day m64645hs + + - + + + + Ref oc_033_park2wrkup Group Natrajan_L pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Natrajan_L/data/m64645hs/nmr/20250724-1130-B400_B.11-56/10/pdata/1/peaks!, pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Natrajan_L/data/m64645hs/nmr/20250724-1130-B400_B.11-56/10/pdata/1/peaks!
54 11:30:05 20250724-0902-B400_B.11-54 10 H1_Day e14150oc x - - - - - - Ref oc_033_part2wrkup Group Winpenny_R WebService Error: 103.310.145:Sample Missing Error:No sample found with Position or Tube ID '1.54'.
43 11:27:31 20250724-1005-B400_B.11-43 13 C13_CPD_Day b72547am - + - - - + + Ref 4-215 Group Larrosa_I
43 11:24:47 20250724-1005-B400_B.11-43 12 Si29_NoCPD_Day b72547am - + - - - + + Ref 4-215 Group Larrosa_I 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/Larrosa_I/data/b72547am/nmr/20250724-1005-B400_B.11-43/12/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/Larrosa_I/data/b72547am/nmr/20250724-1005-B400_B.11-43/12/pdata/1/peaks!
43 11:21:20 20250724-1005-B400_B.11-43 11 Si29_CPD_Day b72547am - + - - - + + Ref 4-215 Group Larrosa_I 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/Larrosa_I/data/b72547am/nmr/20250724-1005-B400_B.11-43/11/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/Larrosa_I/data/b72547am/nmr/20250724-1005-B400_B.11-43/11/pdata/1/peaks!
43 11:16:14 20250724-1005-B400_B.11-43 10 H1_Day16 b72547am + + - + + + + Ref 4-215 Group Larrosa_I
42 11:09:41 20250724-0959-B400_B.11-42 10 H1_Day16 y52364mw + + - + + + + Ref GDB-HW-6-3 Group DeBo_G
40 10:40:57 20250724-0937-B400_B.11-39 40 H1_Day16 f85241bm + x - - - - - Ref BM938-6 Group Bures_J ATM Failed
39 10:40:18 20250724-0937-B400_B.11-39 10 H1_Day16 f85241bm + x - - - - - Ref BM940-10 Group Bures_J ATMA Select Nucleus failed, ATM Failed
38 10:39:44 20250724-0857-B400_B.11-38 11 F19_NoCPD_Day c46714th + x - - - - - Ref TH-607-005-mother liq post wash Group James_M ATMA Select Nucleus failed, ATM Failed
10:39:44 Start-Up - - - - - - - log_err: Status line active!
38 09:04:17 20250724-0857-B400_B.11-38 11 F19_NoCPD_Day c46714th - - - - - - - Ref TH-607-005-mother liq post wash Group James_M
38 08:59:22 20250724-0857-B400_B.11-38 10 H1_Day c46714th + + - + + + + Ref TH-607-005-mother liq post wash Group James_M
36 08:57:59 20250723-1701-B400_B.11-36 11 B11_NoCPD_Day e47904lh - + - - - + + Ref 2 Group Mills_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/Mills_D/data/e47904lh/nmr/20250723-1701-B400_B.11-36/11/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/e47904lh/nmr/20250723-1701-B400_B.11-36/11/pdata/1/peaks!
36 08:53:48 20250723-1701-B400_B.11-36 10 H1_Day16 e47904lh + + - + + + + Ref 2 Group Mills_D sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
35 08:51:40 20250723-1701-B400_B.11-35 11 B11_NoCPD_Day e47904lh - + - - - + + Ref 1 Group Mills_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/Mills_D/data/e47904lh/nmr/20250723-1701-B400_B.11-35/11/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/e47904lh/nmr/20250723-1701-B400_B.11-35/11/pdata/1/peaks!
35 08:47:00 20250723-1701-B400_B.11-35 10 H1_Day16 e47904lh + + - + + + + Ref 1 Group Mills_D sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
41 07:50:29 20250722-1923-B400_B.11-41 11 C13_CPD_Night1024 p16600hw + + - + + + + Ref mfg-whw20250723-1 Group Greaney_M sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
55 07:49:47 20250723-1730-B400_B.11-55 10 H1_Night128 m09677nb - - - - - - - Ref 260 Group Greaney_M
31 07:32:48 20250723-1424-B400_B.11-31 10 C13_CPD_Night256 w12998gm + + - + + + + Ref il-gm-8-087-sm Group Larrosa_I sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
1 07:20:53 20250723-1415-B400_B.11-1 10 H1_Quant_D1_25s_Day q80578pk + + - + + + + Ref MJJ-PK-01-011-0 Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
2 17:44:22 20250723-1414-B400_B.11-2 10 H1_Quant_D1_25s_Day q80578pk x - - - - - - Ref MJJ-PK-01-011-10 Group Other WebService Error: 103.310.145:Sample Missing Error:No sample found with Position or Tube ID '1.2'.
20 17:43:58 20250723-1412-B400_B.11-20 10 H1_Quant_D1_25s_Day q80578pk x - - - - - - Ref MJJ-PK-01-011-9 Group Other WebService Error: 103.310.145:Sample Missing Error:No sample found with Position or Tube ID '1.20'.
19 17:43:29 20250723-1412-B400_B.11-19 10 H1_Quant_D1_25s_Day q80578pk - - - - - - - Ref MJJ-PK-01-011-8 Group Other
18 17:30:40 20250723-1411-B400_B.11-18 10 H1_Quant_D1_25s_Day q80578pk + + - + + + + Ref MJJ-PK-01-011-7 Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
53 17:26:26 20250723-1708-B400_B.11-53 10 Si29_NoCPD_Day v73981ac + + - + + + + Ref ILAC129C-Si Group Larrosa_I pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Larrosa_I/data/v73981ac/nmr/20250723-1708-B400_B.11-53/10/pdata/1/peaks!, pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Larrosa_I/data/v73981ac/nmr/20250723-1708-B400_B.11-53/10/pdata/1/peaks!
52 17:24:33 20250723-1707-B400_B.11-51 21 F19_NoCPD_Day m09677nb - + - - - + + Ref carbazole cf3 Group Greaney_M 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
52 17:18:29 20250723-1707-B400_B.11-51 20 H1_Day16 m09677nb + + - + + + + Ref carbazole cf3 Group Greaney_M
51 17:16:35 20250723-1707-B400_B.11-51 11 F19_NoCPD_Day m09677nb - + - - - + + Ref furan cf3 Group Greaney_M 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
51 17:11:10 20250723-1707-B400_B.11-51 10 H1_Day16 m09677nb + + - + + + + Ref furan cf3 Group Greaney_M
50 16:54:53 20250723-1629-B400_B.11-50 11 C13_CPD_Night256 q62112nk + + - + + + + Ref djp-nk-1-170-1 Group Procter_D sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
53 16:48:55 20250723-1633-B400_B.11-53 10 H1_Day16 mbdxkrn2 + + - + + + + Ref sd006 Group DeBo_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
52 16:44:07 20250723-1633-B400_B.11-52 10 H1_Day16 y52364mw + + - + + + + Ref GDB-MJ-141 Group DeBo_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
51 16:38:44 20250723-1632-B400_B.11-51 10 H1_Day16 y52364mw + + - + + + + Ref GDB-MJ-141-R1 Group DeBo_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
50 16:35:23 20250723-1629-B400_B.11-50 10 H1_Day q62112nk + + - + + + + Ref djp-nk-1-170-1 Group Procter_D
49 16:30:11 20250723-1620-B400_B.11-49 10 H1_Day16 f85241bm + + - + + + + Ref BM938-6 Group Bures_J sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
48 16:25:24 20250723-1619-B400_B.11-48 10 H1_Day16 mbdxkrn2 + + - + + + + Ref sd006-2vial Group DeBo_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
47 16:23:29 20250723-1614-B400_B.11-47 11 C13_CPD_Day z61799af - + - - - + + Ref AF-131-A3 Group Larrosa_I sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
47 16:19:00 20250723-1614-B400_B.11-47 10 H1_Day z61799af + + - + x + + Ref AF-131-A3 Group Larrosa_I topshim: pushParameters - writing parameters from BSMS buffer to BSMS failed - error in BsmsControl::pushParameters: SI_4 : Parameter is out of static range, Shim failed
46 16:16:25 20250723-1548-B400_B.11-46 11 C13_CPD_Day f85241bm - + - - - + + Ref BM939-2 Group Bures_J sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
46 16:11:53 20250723-1548-B400_B.11-46 10 H1_Day16 f85241bm + + - + + + + Ref BM939-2 Group Bures_J
44 16:03:45 20250723-1523-B400_B.11-44 10 H1_Day16 z65435tw + + - + + + + Ref gc-ej-18-p-1h-cdcl3 Group Crisenza_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
43 15:59:38 20250722-1029-B400_B.11-43 12 H1_Day w77242eb + + - + + + + Ref EB-7a Group Shaver_M
42 15:55:28 20250722-1658-B400_B.11-42 11 H1_Day w77242eb + + - + + + + Ref EB-6a Group Shaver_M sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
40 15:53:32 20250723-1515-B400_B.11-40 11 F19_NoCPD_Day c46714th - + - - - + + Ref TH-607-004-filtered mother liquor Group James_M 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 15:48:36 20250723-1515-B400_B.11-40 10 H1_Day c46714th + + - + + + + Ref TH-607-004-filtered mother liquor Group James_M
39 15:41:07 20250723-1521-B400_B.11-39 10 H1_Day z69889rb + + - + + + + Ref SE130 starting material Group Crisenza_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
38 15:36:48 20250723-1521-B400_B.11-38 10 H1_Day16 mbdxkrn2 + + - + + + + Ref GDB-RN1390 Column Main Band - Acetone-d6 Group DeBo_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
37 15:32:10 20250723-1519-B400_B.11-37 10 H1_Day16 mbdxkrn2 + + - + + + + Ref GDB-RN1548(ii) Crude - Acetone-d6 Group DeBo_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
36 15:27:24 20250722-1541-B400_B.11-36 11 H1_Day w77242eb + + - + + + + Ref EB-5a Group Shaver_M sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
35 15:22:58 20250722-1540-B400_B.11-35 12 H1_Day w77242eb + + - + + + + Ref EB-4a Group Shaver_M sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
34 15:19:31 20250722-1533-B400_B.11-34 17 H1_Day w77242eb + + - + + + + Ref EB-3a Group Shaver_M sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
33 15:16:15 20250722-1513-B400_B.11-33 11 H1_Day w77242eb + + - + + + + Ref EB-2a Group Shaver_M sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
32 15:12:41 20250722-1513-B400_B.11-32 11 H1_Day w77242eb + + - + + + + Ref EB-1a Group Shaver_M sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
27 14:59:58 20250723-1423-B400_B.11-27 10 H1_Quant_D1_25s_Day w12998gm + + - + + + + Ref il-gm-8-080-ii-j-crude Group Larrosa_I sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
26 14:56:31 20250721-1912-B400_B.11-26 11 H1_Day j20588jh + + - + + + + Ref JH-DW-26.20.1-DippZnAlCl 4-ClPhN3 Group Willcox_D Hex insol sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
25 14:53:15 20250721-1814-B400_B.11-25 15 H1_Day j20588jh + + - + + + + Ref JH-DW-26.15.1-DippZnAlCl 4-MePhN3 Group Willcox_D Hex insol sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
24 14:49:21 20250721-1812-B400_B.11-24 15 H1_Day j20588jh + + - + + + + Ref JH-DW-26.08.2-DippZnAlCl TMSN3 Group Willcox_D Hex crys
23 14:36:55 20250723-1423-B400_B.11-23 10 H1_Quant_D1_25s_Day w12998gm + + - + + + + Ref il-gm-8-085-j-i Group Larrosa_I sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
22 14:33:28 20250723-1418-B400_B.11-22 10 H1_Day z69889rb + + - + + + + Ref SE130 Group Crisenza_G
21 14:26:21 20250723-1417-B400_B.11-21 10 H1_Day z69889rb + + - + + + + Ref glorious hydrogenation Group Crisenza_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
17 14:22:04 20250723-1346-B400_B.11-17 10 H1_Day m52750pm + + - + + + + Ref GCPM89cru Group Crisenza_G
16 14:20:14 20250723-1344-B400_B.11-16 11 F19_NoCPD_Day c46714th - + - - - + + Ref TH6-07-003-solids Group James_M 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
16 14:15:57 20250723-1344-B400_B.11-16 10 H1_Day c46714th + + - + + + + Ref TH6-07-003-solids Group James_M
15 14:14:01 20250723-1343-B400_B.11-15 11 F19_NoCPD_Day c46714th - + - - - + + Ref TH-607-002-mother liquor Group James_M 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 14:09:56 20250723-1343-B400_B.11-15 10 H1_Day c46714th + + - + + + + Ref TH-607-002-mother liquor Group James_M
14 14:05:27 20250723-1342-B400_B.11-14 10 H1_Day mbyxaac2 + + - + + + + Ref DP-AC-410 Group Butterworth_S
13 13:59:55 20250723-1331-B400_B.11-12 20 H1_Day16 f85241bm + + - + + + + Ref BM940-3 Group Bures_J sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
12 13:53:45 20250723-1331-B400_B.11-12 10 H1_Day16 f85241bm + + - + x + + Ref BM940-2 Group Bures_J 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
11 13:41:37 20250723-1217-B400_B.11-11 10 H1_Quant_D1_25s_Day q80578pk + + - + + + + Ref MJJ-PK-01-011-6 Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
10 13:29:00 20250723-1216-B400_B.11-10 10 H1_Quant_D1_25s_Day q80578pk + + - + + + + Ref MJJ-PK-01-011-5 Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
9 13:25:06 20250723-1248-B400_B.11-9 10 H1_Day e03178pd + + - + + + + Ref IL-pdl732.cr Group Larrosa_I sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
8 13:20:15 20250723-1241-B400_B.11-8 10 H1_Day q85514th + + - + + + + Ref 504DI F6-9 Group Greaney_M
7 13:15:43 20250723-1241-B400_B.11-7 10 H1_Day q85514th + + - + + + + Ref TH504DI F1-5 Group Greaney_M
6 13:12:15 20250723-1223-B400_B.11-6 10 H1_Day h68355ac + + - + + + + Ref MFG-AC-589-(b) Group Greaney_M
5 13:08:40 20250723-1223-B400_B.11-5 10 H1_Day h68355ac + + - + + + + Ref MFG-AC-589-(a) Group Greaney_M sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
4 12:56:36 20250723-1216-B400_B.11-4 10 H1_Quant_D1_25s_Day q80578pk + + - + + + + Ref MJJ-PK-01-011-4 Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
3 12:44:10 20250723-1216-B400_B.11-3 10 H1_Quant_D1_25s_Day q80578pk + + - + + + + Ref MJJ-PK-01-011-3 Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
2 12:32:03 20250723-1216-B400_B.11-2 10 H1_Quant_D1_25s_Day q80578pk + + - + + + + Ref MJJ-PK-01-011-2 Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
1 12:19:42 20250723-1215-B400_B.11-1 10 H1_Quant_D1_25s_Day q80578pk + + - + + + + Ref MJJ-PK-01-011-1 Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
7 11:49:34 20250723-1144-B400_B.11-7 11 F19_NoCPD_Day c46714th - + - - - + + Ref TH-607-001-cr Group James_M 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 11:45:20 20250723-1144-B400_B.11-7 10 H1_Day c46714th + + - + + + + Ref TH-607-001-cr Group James_M
6 11:39:38 20250723-1139-B400_B.11-6 10 H1_Day x25009jo + + - + + + + Ref GDB-JO-858-2 Group DeBo_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
5 11:20:28 20250723-1119-B400_B.11-5 10 H1_Day m52750pm + + - + + + + Ref GCPM87cru Group Crisenza_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
4 11:03:57 20250723-1103-B400_B.11-4 10 H1_Day mbdxrbj2 + + - + + + + Ref BJ544 Group Procter_D sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
3 10:58:24 20250723-1046-B400_B.11-3 10 H1_Day16 mbdxkrn2 + + - + x + + Ref hw-8 Group DeBo_G topshim: pushParameters - writing parameters from BSMS buffer to BSMS failed - error in BsmsControl::pushParameters: SI_4 : Parameter is out of static range, Shim failed
2 10:53:52 20250723-1045-B400_B.11-2 10 H1_Day16 mbdxkrn2 + + - + + + + Ref hw-7 Group DeBo_G
1 10:47:51 20250723-1045-B400_B.11-1 10 H1_Day16 mbdxkrn2 + + - + + + + Ref hw-6 third Group DeBo_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
58 10:31:15 20250723-1030-B400_B.11-58 10 H1_Day16 mbdxkrn2 + + - + + + + Ref GDB-RN1548(i) Crude after 3rd H+ - Acetone-d6 Group DeBo_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
16 09:47:53 20250723-0938-B400_B.11-16 10 H1_Day mbdxkrn2 + + - + + + + Ref sd005 Group DeBo_G
15 09:43:33 20250723-0930-B400_B.11-15 10 H1_Day16 w52164bc + + - + + + + Ref BC-11-038 PhMe Group James_M sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
14 09:37:47 20250723-0930-B400_B.11-14 10 H1_Day16 w52164bc + + - + + + + Ref BC-11-035 2.0 equiv. Group James_M
13 09:33:07 20250723-0929-B400_B.11-13 10 H1_Day16 w52164bc + + - + + + + Ref BC-11-027 P2-t-Bu Group James_M sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
12 09:27:29 20250723-0926-B400_B.11-12 10 P31_Wide_Day c62220rg + + - + + + + Ref at-rg-4-48-r1 Group Trowbridge_A 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
11 08:44:57 20250723-0844-B400_B.11-11 10 H1_Day16 mbdxkrn2 + + - + + + + Ref GDB-RN1548(i) Crude after 1st H+ - Acetone-d6 Group DeBo_G
4 08:40:19 20250723-0838-B400_B.11-4 10 H1_Day g23544jd + + - + + + + Ref MJJ-JDL-05-421-14 Group James_M sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
3 08:36:55 20250723-0830-B400_B.11-3 10 H1_Day g23544jd + + - + + + + Ref MJJ-JDL-05-421-5 (prev 5 was 6) Group James_M sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
4 08:33:07 20250723-0830-B400_B.11-4 10 H1_Day g23544jd + + - + + + + Ref MJJ-JDL-05-421-12 Group James_M sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
2 08:29:27 20250723-0828-B400_B.11-2 10 H1_Day g23544jd + + - + + + + Ref MJJ-JDL-05-021-5 Group James_M sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
41 07:58:58 20250722-1923-B400_B.11-41 10 H1_Day p16600hw + + - + + + + Ref mfg-whw20250723-1 Group Greaney_M
17 07:57:02 20250722-1839-B400_B.11-17 13 F19_NoCPD_Day m69065je - + - - - + + Ref JEK601_htd80_t16 Group Mills_D JEK601_htd80_t16 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 'capillary_C6D6' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'capillary_C6D6' SR is set to 0.0
17 07:26:20 20250722-1839-B400_B.11-17 12 H1_Si29_HMBC_Night m69065je - + - - - + + Ref JEK601_htd80_t16 Group Mills_D JEK601_htd80_t16 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
17 06:32:28 20250722-1839-B400_B.11-17 11 Si29_DEPT90_Night m69065je - + - - - + + Ref JEK601_htd80_t16 Group Mills_D JEK601_htd80_t16 sref: NUCLEUS '29Si' not defined for SOLVENT 'capillary_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/20250722-1839-B400_B.11-17/11/pdata/1/peaks!, sref: NUCLEUS '29Si' not defined for SOLVENT 'capillary_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/20250722-1839-B400_B.11-17/11/pdata/1/peaks!
17 06:27:30 20250722-1839-B400_B.11-17 10 H1_Night m69065je + + - + + + + Ref JEK601_htd80_t16 Group Mills_D JEK601_htd80_t16 pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Mills_D/data/m69065je/nmr/20250722-1839-B400_B.11-17/10/pdata/1/peaks!, pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Mills_D/data/m69065je/nmr/20250722-1839-B400_B.11-17/10/pdata/1/peaks!
16 06:26:01 20250722-1838-B400_B.11-16 13 B11_NoCPD_Day m69065je - + - - - + + Ref JEK600_htd80_t16 Group Mills_D JEK600_htd80_t16 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/20250722-1838-B400_B.11-16/13/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/20250722-1838-B400_B.11-16/13/pdata/1/peaks!
16 05:55:08 20250722-1838-B400_B.11-16 12 H1_Si29_HMBC_Night m69065je - + - - - + + Ref JEK600_htd80_t16 Group Mills_D JEK600_htd80_t16 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 05:01:03 20250722-1838-B400_B.11-16 11 Si29_DEPT90_Night m69065je - + - - - + + Ref JEK600_htd80_t16 Group Mills_D JEK600_htd80_t16 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/20250722-1838-B400_B.11-16/11/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/m69065je/nmr/20250722-1838-B400_B.11-16/11/pdata/1/peaks!
16 04:56:20 20250722-1838-B400_B.11-16 10 H1_Night m69065je + + - + + + + Ref JEK600_htd80_t16 Group Mills_D JEK600_htd80_t16
42 03:27:50 20250722-1658-B400_B.11-42 10 H1_Night1024 x25009jo + + - + + + + Ref GDB-JO-864-2-PNW Group DeBo_G
34 03:14:50 20250722-1533-B400_B.11-34 16 H1_NOESY_Night mbdxkrn2 - + - - - + + Ref GDB-RN1547 Full Char - Acetone-d6 Group DeBo_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
34 03:01:20 20250722-1533-B400_B.11-34 15 H1_COSY_HiRes_Night mbdxkrn2 - + - - - + + Ref GDB-RN1547 Full Char - Acetone-d6 Group DeBo_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
34 02:45:59 20250722-1533-B400_B.11-34 14 H1_C13_HSQC_Night mbdxkrn2 - + - - - + + Ref GDB-RN1547 Full Char - Acetone-d6 Group DeBo_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
34 02:10:50 20250722-1533-B400_B.11-34 13 H1_C13_HMBC_Night mbdxkrn2 - + - - - + + Ref GDB-RN1547 Full Char - Acetone-d6 Group DeBo_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
34 02:08:36 20250722-1533-B400_B.11-34 12 H1_Night mbdxkrn2 - + - - - + + Ref GDB-RN1547 Full Char - Acetone-d6 Group DeBo_G
34 00:19:28 20250722-1533-B400_B.11-34 11 C13_CPD_Night1024 mbdxkrn2 + + - + + + + Ref GDB-RN1547 Full Char - Acetone-d6 Group DeBo_G
30 00:18:49 20250722-2351-B400_B.11-29 20 F19_NoCPD_Night m09677nb + x - - - - - Ref furan cf3 2nd Group Greaney_M ATM Failed
29 00:18:09 20250722-2351-B400_B.11-29 10 F19_NoCPD_Night m09677nb - - - - - - - Ref furan cf3 1st Group Greaney_M
28 23:20:07 20250722-1416-B400_B.11-28 10 C13_CPD_Night1024 mbyxaac2 + + - + + + + Ref DP-AC-407-2 Group Butterworth_S sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
3 23:19:24 20250722-2209-B400_B.11-2 20 F19_NoCPD_Night m09677nb + x - - - - - Ref 2nd spot Group Greaney_M ATM Failed
2 23:18:39 20250722-2209-B400_B.11-2 10 F19_NoCPD_Night m09677nb - - - - - - - Ref 1st spot Group Greaney_M
52 23:13:07 20250722-2141-B400_B.11-52 10 H1_Night y52364mw + + - + + + + Ref GDB-MJ-141-R1 Group DeBo_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
51 22:59:39 20250722-2141-B400_B.11-51 11 H1_COSY_HiRes_Night y52364mw - + - - - + + Ref GDB-MJ-141-1 Group DeBo_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 22:53:35 20250722-2141-B400_B.11-51 10 H1_Night y52364mw + + - + + + + Ref GDB-MJ-141-1 Group DeBo_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
56 21:24:42 20250722-1102-B400_B.11-56 11 H1_Night1024 y37570lc + + - + + + + Ref lc544-4 Group DeBo_G
59 21:24:32 20250722-1935-B400_B.11-58 21 F19_NoCPD_Night m09677nb - - - - - - - Ref furan cf3 2nd spot Group Greaney_M
59 21:09:22 20250722-1935-B400_B.11-58 20 H1_Night128 m09677nb + + - + + + + Ref furan cf3 2nd spot Group Greaney_M
58 21:09:12 20250722-1935-B400_B.11-58 11 F19_NoCPD_Night m09677nb - - - - - - - Ref furan cf3 1st spot Group Greaney_M
58 20:55:09 20250722-1935-B400_B.11-58 10 H1_Night128 m09677nb + + - + + + + Ref furan cf3 1st spot Group Greaney_M
57 20:48:54 20250722-1922-B400_B.11-57 10 H1_Night y52364mw + + - + + + + Ref GDB-MJ-141 Group DeBo_G
55 19:19:49 20250722-1102-B400_B.11-55 11 H1_Night1024 y37570lc + + - + + + + Ref lc544-3 Group DeBo_G
15 19:18:07 20250722-1837-B400_B.11-15 12 B11_NoCPD_Day m69065je - + - - - + + Ref JEK599_t0 Group Mills_D JEK599_t0 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/20250722-1837-B400_B.11-15/12/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/Mills_D/data/m69065je/nmr/20250722-1837-B400_B.11-15/12/pdata/1/peaks!
15 19:12:43 20250722-1837-B400_B.11-15 11 Si29_DEPT90_Day m69065je - + - - - + + Ref JEK599_t0 Group Mills_D JEK599_t0 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/20250722-1837-B400_B.11-15/11/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/m69065je/nmr/20250722-1837-B400_B.11-15/11/pdata/1/peaks!
15 19:07:58 20250722-1837-B400_B.11-15 10 H1_Day16 m69065je + + - + + + + Ref JEK599_t0 Group Mills_D JEK599_t0 sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
54 17:38:57 20250722-1101-B400_B.11-54 11 H1_Night1024 y37570lc + + - + + + + Ref lc544-2 Group DeBo_G
41 17:23:43 20250722-1652-B400_B.11-41 10 H1_Night128 x25009jo + + - + + + + Ref HDB-JO-858-2 Group DeBo_G
39 17:23:33 20250722-1545-B400_B.11-39 12 F19_NoCPD_Night h68355ac - - - - - - - Ref MFG-AC-517-(a)-full-2 Group Greaney_M
39 17:09:11 20250722-1545-B400_B.11-39 11 C13_CPD_Night256 h68355ac - + - - - + + Ref MFG-AC-517-(a)-full-2 Group Greaney_M sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
39 17:04:46 20250722-1545-B400_B.11-39 10 H1_Night h68355ac + + - + + + + Ref MFG-AC-517-(a)-full-2 Group Greaney_M sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
38 17:04:36 20250722-1544-B400_B.11-38 12 F19_NoCPD_Night h68355ac - - - - - - - Ref MFG-AC-493-(b)-full-2 Group Greaney_M
38 16:50:15 20250722-1544-B400_B.11-38 11 C13_CPD_Night256 h68355ac - + - - - + + Ref MFG-AC-493-(b)-full-2 Group Greaney_M sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
38 16:46:03 20250722-1544-B400_B.11-38 10 H1_Night h68355ac + + - + + + + Ref MFG-AC-493-(b)-full-2 Group Greaney_M sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
37 16:45:53 20250722-1543-B400_B.11-37 12 F19_NoCPD_Night h68355ac - - - - - - - Ref MFG-AC448-(a)-full-2 Group Greaney_M
37 16:31:32 20250722-1543-B400_B.11-37 11 C13_CPD_Night256 h68355ac - + - - - + + Ref MFG-AC448-(a)-full-2 Group Greaney_M sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
37 16:25:47 20250722-1543-B400_B.11-37 10 H1_Night h68355ac + + - + + + + Ref MFG-AC448-(a)-full-2 Group Greaney_M sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
41 16:22:44 20250722-1614-B400_B.11-41 10 H1_Day x25009jo + + - + + + + Ref GDB-JO-858-2 Group DeBo_G
40 16:20:46 20250722-1609-B400_B.11-40 12 F19_NoCPD_Day h68355ac - + - - - + + Ref 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 16:18:07 20250722-1609-B400_B.11-40 11 C13_CPD_Day h68355ac - + - - - + + Ref sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
40 16:14:39 20250722-1609-B400_B.11-40 10 H1_Day h68355ac + + - + + + + Ref sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
36 16:09:49 20250722-1541-B400_B.11-36 10 H1_Day16 r57145lg + + - + + + + Ref capg_LPG_PGT001-2 Group Goodwin_C Distilled
35 16:07:13 20250722-1540-B400_B.11-35 11 P31_Wide_Day r57145lg - + - - - + + Ref capg_LPG_COTScC6HtBu3_CrudeChk Group Goodwin_C oDFB
35 16:03:49 20250722-1540-B400_B.11-35 10 H1_Day16 r57145lg + + - + + + + Ref capg_LPG_COTScC6HtBu3_CrudeChk Group Goodwin_C oDFB pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Goodwin_C/data/r57145lg/nmr/20250722-1540-B400_B.11-35/10/pdata/1/peaks!, pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Goodwin_C/data/r57145lg/nmr/20250722-1540-B400_B.11-35/10/pdata/1/peaks!
34 15:58:42 20250722-1533-B400_B.11-34 10 H1_Day16 mbdxkrn2 + + - + + + + Ref GDB-RN1547 Column Top Band - Acetone-d6 Group DeBo_G
33 15:53:08 20250722-1513-B400_B.11-33 10 H1_Day16 f85241bm + + - + + + + Ref BM939-2 Group Bures_J
32 15:48:38 20250722-1513-B400_B.11-32 10 H1_Day16 f85241bm + + - + + + + Ref BM940-1 Group Bures_J end of reaction
31 15:36:18 20250722-1504-B400_B.11-31 10 H1_Quant_D1_25s_Day q80578pk + + - + + + + Ref MJJ-PK-01-010-4 Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
30 15:24:12 20250722-1504-B400_B.11-30 10 H1_Quant_D1_25s_Day q80578pk + + - + + + + Ref MJJ-PK-01-010-2 Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
29 15:12:05 20250722-1504-B400_B.11-29 10 H1_Quant_D1_25s_Day q80578pk + + - + + + + Ref MJJ-PK-01-010-1 Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
27 14:59:30 20250722-1349-B400_B.11-27 10 H1_Quant_D1_25s_Day w12998gm + + - + + + + Ref il-gm-8-080-ii-M Group Larrosa_I sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
8 14:58:17 20250722-1130-B400_B.11-8 11 H1_Day w52164bc - + - - - + + Ref BC-11-035 2.0 equiv. Group James_M
8 14:53:12 20250722-1130-B400_B.11-8 10 H1_Day16 w52164bc + + - + + + + Ref BC-11-035 2.0 equiv. Group James_M
2 14:39:28 20250722-1105-B400_B.11-2 11 H1_Quant_D1_25s_Day q80578pk x - - - - - - Ref MJJ-PK-01-010-1 Group Other WebService Error: Changer has been busy for the past 5 minutes. Cannot transfer the sample.
8 14:34:10 20250722-1130-B400_B.11-8 11 H1_Day w52164bc x - - - - - - Ref BC-11-035 2.0 equiv. Group James_M WebService Error: Changer has been busy for the past 5 minutes. Cannot transfer the sample.
27 14:33:05 20250722-1349-B400_B.11-27 10 H1_Quant_D1_25s_Day w12998gm - - - - - - - Ref il-gm-8-080-ii-M Group Larrosa_I
23 14:21:02 20250722-1348-B400_B.11-23 10 H1_Quant_D1_25s_Day w12998gm + + - + + + + Ref il-gm-8-080-ii-L Group Larrosa_I sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
19 14:08:59 20250722-1348-B400_B.11-19 10 H1_Quant_D1_25s_Day w12998gm + + - + + + + Ref il-gm-8-080-i-m Group Larrosa_I sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
15 13:56:38 20250722-1348-B400_B.11-15 10 H1_Quant_D1_25s_Day w12998gm + + - + + + + Ref il-gm-8-080-i-L Group Larrosa_I sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
12 13:44:31 20250722-1122-B400_B.11-12 11 H1_Quant_D1_25s_Day q80578pk + + - + + + + Ref MJJ-PK-01-010-5 Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
11 13:32:12 20250722-1121-B400_B.11-11 11 H1_Quant_D1_25s_Day q80578pk + + - + + + + Ref MJJ-PK-01-010-4 Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
1 13:19:31 20250722-1244-B400_B.11-1 10 H1_Quant_D1_25s_Day q80578pk + + - + + + + Ref MJJ-PK-01-010-control Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
17 13:13:44 20250722-1127-B400_B.11-17 10 H1_Day16 w52164bc + + - + + + + Ref BC-11-037 40 mol% Group James_M
16 13:09:20 20250722-1127-B400_B.11-16 10 H1_Day16 w52164bc + + - + + + + Ref BC-11-034 Ph4PBr Group James_M sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
15 13:04:05 20250722-1126-B400_B.11-15 10 H1_Day16 w52164bc + + - + + + + Ref BC-11-033 Bu4N.HSO4 Group James_M sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
14 13:00:57 20250722-1122-B400_B.11-14 10 H1_Day q80578pk + + - + + + + Ref MJJ-PK-01-010-7 Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
13 12:57:44 20250722-1122-B400_B.11-13 10 H1_Day q80578pk + + - + + + + Ref MJJ-PK-01-010-6 Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
12 12:54:35 20250722-1122-B400_B.11-12 10 H1_Day q80578pk + + - + + + + Ref MJJ-PK-01-010-5 Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
11 12:50:49 20250722-1121-B400_B.11-11 10 H1_Day q80578pk + + - + + + + Ref MJJ-PK-01-010-4 Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
10 12:45:03 20250722-1234-B400_B.11-10 10 H1_Day h68355ac + + - + + + + Ref MFG-AC-585-col Group Greaney_M sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
9 12:40:33 20250722-1130-B400_B.11-9 10 H1_Day16 w52164bc + + - + + + + Ref BC-11-036 2.5 equiv. Group James_M
8 12:35:23 20250722-1130-B400_B.11-8 10 H1_Day16 w52164bc + + - + + + + Ref BC-11-035 2.0 equiv. Group James_M
7 12:29:37 20250722-1126-B400_B.11-7 10 H1_Day16 w52164bc + + - + + + + Ref BC-11-032 control Group James_M sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
6 12:24:27 20250722-1203-B400_B.11-6 10 H1_Day16 f85241bm + + - + + + + Ref BM939-1 Group Bures_J
5 12:17:27 20250722-1158-B400_B.11-5 10 H1_Day16 y52364mw + + - + + + + Ref GDB-HW-5-new Group DeBo_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
4 12:14:20 20250722-1106-B400_B.11-4 10 H1_Day q80578pk + + - + + + + Ref MJJ-PK-01-010-3 Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
3 12:11:15 20250722-1105-B400_B.11-3 10 H1_Day q80578pk + + - + + + + Ref MJJ-PK-01-010-2 Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
2 12:08:06 20250722-1105-B400_B.11-2 10 H1_Day q80578pk + + - + + + + Ref MJJ-PK-01-010-1 Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
1 12:06:51 20250722-1104-B400_B.11-1 11 H1_Day q80578pk - + - - - + + Ref MJJ-PK-01-010-0 Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
1 11:54:26 20250722-1104-B400_B.11-1 10 H1_Quant_D1_25s_Day q80578pk + + - + + + + Ref MJJ-PK-01-010-0 Group Other sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
59 11:49:56 20250722-1125-B400_B.11-59 10 H1_Day16 w52164bc + + - + + + + Ref BC-11-031 Phosp Group James_M sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
58 11:45:34 20250722-1124-B400_B.11-58 10 H1_Day16 w52164bc + + - + + + + Ref BC-11-030 i-Pr Group James_M
57 11:39:32 20250722-1124-B400_B.11-57 10 H1_Day16 w52164bc + + - + + + + Ref BC-11-022 18-C-6 KOt-Bu Group James_M sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
56 11:35:19 20250722-1102-B400_B.11-56 10 H1_Day16 y37570lc + + - + + + + Ref lc544-4 Group DeBo_G
55 11:31:08 20250722-1102-B400_B.11-55 10 H1_Day16 y37570lc + + - + + + + Ref lc544-3 Group DeBo_G
54 11:26:19 20250722-1101-B400_B.11-54 10 H1_Day16 y37570lc + + - + + + + Ref lc544-2 Group DeBo_G
53 11:21:51 20250722-1100-B400_B.11-52 20 H1_Day x06125gb + + - + + + + Ref GCGBHex Group Crisenza_G
52 11:16:57 20250722-1100-B400_B.11-52 10 H1_Day x06125gb + + - + + + + Ref GCGBPhMe Group Crisenza_G
51 11:12:10 20250722-1052-B400_B.11-51 10 H1_Day16 m14269jw + + - + + + + Ref IR-JW-3070-PPT Group Riddell_I sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
50 11:07:41 20250722-1052-B400_B.11-50 10 H1_Day q62112nk + + - + + + + Ref djp-nk-1-157-2spot Group Procter_D
49 11:02:07 20250722-1047-B400_B.11-49 10 H1_Day z69889rb + + - + + + + Ref glorious reduction Group Crisenza_G
48 10:57:32 20250722-1033-B400_B.11-48 10 H1_Day mbdxkrn2 + + - + + + + Ref sd004 Group DeBo_G
47 10:51:24 20250722-1032-B400_B.11-47 10 H1_Day mbdxkrn2 + + - + + + + Ref sd005 Group DeBo_G
46 10:45:31 20250722-1032-B400_B.11-46 10 H1_Day16 mbdxkrn2 + + - + + + + Ref hw-6-new Group DeBo_G
45 10:41:46 20250722-1031-B400_B.11-45 10 H1_Day h68355ac + + - + + + + Ref MFG-AC-588 Group Greaney_M
44 10:39:29 20250722-1030-B400_B.11-44 11 F19_NoCPD_Day u67812sg - + - - - + + Ref sq-01-129-1 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
44 10:36:06 20250722-1030-B400_B.11-44 10 H1_Day u67812sg + + - + + + + Ref sq-01-129-1 Group Procter_D
43 10:33:50 20250722-1029-B400_B.11-43 11 F19_NoCPD_Day u67812sg - + - - - + + Ref sq-01-129-2 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
43 10:30:22 20250722-1029-B400_B.11-43 10 H1_Day u67812sg + + - + + + + Ref sq-01-129-2 Group Procter_D
41 05:45:11 20250721-2038-B400_B.11-41 13 F19_NoCPD_Day p16600hw - + - - - + + Ref mfg-whw20250722-1 Group Greaney_M 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
41 05:17:56 20250721-2038-B400_B.11-41 12 C13_DEPT135_Night p16600hw - + - - - + + Ref mfg-whw20250722-1 Group Greaney_M
41 04:24:11 20250721-2038-B400_B.11-41 11 C13_CPD_Night1024 p16600hw - + - - - + + Ref mfg-whw20250722-1 Group Greaney_M
41 04:19:55 20250721-2038-B400_B.11-41 10 H1_Day p16600hw + + - + + + + Ref mfg-whw20250722-1 Group Greaney_M
27 03:22:05 20250721-1914-B400_B.11-27 10 C13_CPD_Night1024 m09677nb + + - + + + + Ref dbf cf3 Group Greaney_M sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
25 03:20:08 20250721-1814-B400_B.11-25 14 F19_NoCPD_Day m69065je - + - - - + + Ref JEK601_htd80_t8 Group Mills_D JEK601_htd80_t8 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 'capillary_C6D6' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'capillary_C6D6' SR is set to 0.0
25 02:49:26 20250721-1814-B400_B.11-25 13 H1_Si29_HMBC_Night m69065je - + - - - + + Ref JEK601_htd80_t8 Group Mills_D JEK601_htd80_t8 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 01:55:59 20250721-1814-B400_B.11-25 12 Si29_DEPT90_Night m69065je - + - - - + + Ref JEK601_htd80_t8 Group Mills_D JEK601_htd80_t8 sref: NUCLEUS '29Si' not defined for SOLVENT 'capillary_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/20250721-1814-B400_B.11-25/12/pdata/1/peaks!, sref: NUCLEUS '29Si' not defined for SOLVENT 'capillary_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/20250721-1814-B400_B.11-25/12/pdata/1/peaks!
25 01:42:28 20250721-1814-B400_B.11-25 11 H1_COSY_HiRes_Night m69065je - + - - - + + Ref JEK601_htd80_t8 Group Mills_D JEK601_htd80_t8 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 01:37:48 20250721-1814-B400_B.11-25 10 H1_Night m69065je + + - + + + + Ref JEK601_htd80_t8 Group Mills_D JEK601_htd80_t8 pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Mills_D/data/m69065je/nmr/20250721-1814-B400_B.11-25/10/pdata/1/peaks!, pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Mills_D/data/m69065je/nmr/20250721-1814-B400_B.11-25/10/pdata/1/peaks!
24 01:07:07 20250721-1812-B400_B.11-24 14 H1_Si29_HMBC_Night m69065je - + - - - + + Ref JEK600_htd80_t8 Group Mills_D JEK600_htd80_t8 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 00:13:11 20250721-1812-B400_B.11-24 13 Si29_DEPT90_Night m69065je - + - - - + + Ref JEK600_htd80_t8 Group Mills_D JEK600_htd80_t8 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/20250721-1812-B400_B.11-24/13/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/20250721-1812-B400_B.11-24/13/pdata/1/peaks!
24 00:11:15 20250721-1812-B400_B.11-24 12 B11_NoCPD_Day m69065je - + - - - + + Ref JEK600_htd80_t8 Group Mills_D JEK600_htd80_t8 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/20250721-1812-B400_B.11-24/12/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/Mills_D/data/m69065je/nmr/20250721-1812-B400_B.11-24/12/pdata/1/peaks!
24 23:57:42 20250721-1812-B400_B.11-24 11 H1_COSY_HiRes_Night m69065je - + - - - + + Ref JEK600_htd80_t8 Group Mills_D JEK600_htd80_t8 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 23:53:23 20250721-1812-B400_B.11-24 10 H1_Night m69065je + + - + + + + Ref JEK600_htd80_t8 Group Mills_D JEK600_htd80_t8 sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
22 23:39:56 20250721-1638-B400_B.11-22 14 H1_COSY_HiRes_Night mbdxkrn2 - + - - - + + Ref GDB-RN1546(iv) Full Char - Acetone-d6 Group DeBo_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 23:24:34 20250721-1638-B400_B.11-22 13 H1_C13_HSQC_Night mbdxkrn2 - + - - - + + Ref GDB-RN1546(iv) Full Char - Acetone-d6 Group DeBo_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 22:49:25 20250721-1638-B400_B.11-22 12 H1_C13_HMBC_Night mbdxkrn2 - + - - - + + Ref GDB-RN1546(iv) Full Char - Acetone-d6 Group DeBo_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 22:47:11 20250721-1638-B400_B.11-22 11 H1_Night mbdxkrn2 - + - - - + + Ref GDB-RN1546(iv) Full Char - Acetone-d6 Group DeBo_G
22 21:50:43 20250721-1638-B400_B.11-22 10 C13_CPD_Night1024 mbdxkrn2 + + - + + + + Ref GDB-RN1546(iv) Full Char - Acetone-d6 Group DeBo_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
23 21:44:55 20250721-2132-B400_B.11-23 10 H1_Night y52364mw + + - + + + + Ref GDB-MJ-140 Group DeBo_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
21 20:15:52 20250721-1633-B400_B.11-21 10 H1_Night1024 x25009jo + + - + + + + Ref GDB-JO-851-H2O-Et2O Group DeBo_G
26 20:01:00 20250721-1912-B400_B.11-26 10 H1_Night128 m09677nb + + - + + + + Ref carbazole cf3 Group Greaney_M
23 19:46:44 20250721-1832-B400_B.11-23 11 C13_CPD_Night256 z69889rb - + - - - + + Ref SE128B Group Crisenza_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
23 19:37:12 20250721-1832-B400_B.11-23 10 H1_Night z69889rb + + - + + + + Ref SE128B Group Crisenza_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
20 18:08:10 20250721-1633-B400_B.11-20 10 H1_Night1024 x25009jo + + - + + + + Ref GDB-JO-852-H2O-P Group DeBo_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
18 17:30:07 20250721-1612-B400_B.11-18 15 H1_C13_HMBC_Night r57145lg + + - + + + + Ref capg_LPG_PGT001_Distilled Group Goodwin_C 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 17:04:13 20250721-1648-B400_B.11-19 10 H1_Day x25009jo + + - + + + + Ref GDB-JO-870-2 Group DeBo_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
18 16:48:51 20250721-1612-B400_B.11-18 14 H1_C13_HSQC_Night r57145lg - + - - - + + Ref capg_LPG_PGT001_Distilled Group Goodwin_C 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
18 16:35:18 20250721-1612-B400_B.11-18 13 H1_COSY_HiRes_Night r57145lg - + - - - + + Ref capg_LPG_PGT001_Distilled Group Goodwin_C 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
18 16:20:25 20250721-1612-B400_B.11-18 12 C13_CPD_Night256 r57145lg - + - - - + + Ref capg_LPG_PGT001_Distilled Group Goodwin_C sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
18 16:18:11 20250721-1612-B400_B.11-18 11 H1_Night r57145lg - + - - - + + Ref capg_LPG_PGT001_Distilled Group Goodwin_C
18 16:13:20 20250721-1612-B400_B.11-18 10 H1_Day16 r57145lg + + - + + + + Ref capg_LPG_PGT001_Distilled Group Goodwin_C
16 15:53:36 20250721-1552-B400_B.11-16 10 H1_Day16 f85241bm + + - + + + + Ref BM938-9 Group Bures_J
15 15:21:01 20250721-1520-B400_B.11-15 10 H1_Day16 h91839em + + - + + + + Ref GC EM 64 C Group Crisenza_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
12 14:53:56 20250721-1438-B400_B.11-10 30 H1_Day16 f85241bm + + - + + + + Ref BM938-4 Group Bures_J
11 14:48:09 20250721-1438-B400_B.11-10 20 H1_Day16 f85241bm + + - + + + + Ref BM938-5 Group Bures_J sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
10 14:40:11 20250721-1438-B400_B.11-10 10 H1_Day16 f85241bm + + - + + + + Ref BM938-6 Group Bures_J sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
9 14:13:38 20250721-1409-B400_B.11-9 10 H1_Day16 y52364mw + + - + + + + Ref GDB-MJ-134-CuBr2-t2-crude Group DeBo_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
8 14:09:06 20250721-1400-B400_B.11-8 10 H1_Day z69889rb + + - + + + + Ref glorious terza Group Crisenza_G sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
7 14:04:41 20250721-1359-B400_B.11-7 10 H1_Day z69889rb + + - + + + + Ref SE128 Group Crisenza_G
6 14:02:46 20250721-1330-B400_B.11-6 12 F19_NoCPD_Day m69065je - + - - - + + Ref JEK601_htd80_t4 Group Mills_D JEK601_htd80_t4 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 'capillary_C6D6' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'capillary_C6D6' SR is set to 0.0
6 13:57:35 20250721-1330-B400_B.11-6 11 Si29_DEPT90_Day m69065je - + - - - + + Ref JEK601_htd80_t4 Group Mills_D JEK601_htd80_t4 sref: NUCLEUS '29Si' not defined for SOLVENT 'capillary_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/20250721-1330-B400_B.11-6/11/pdata/1/peaks!, sref: NUCLEUS '29Si' not defined for SOLVENT 'capillary_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/20250721-1330-B400_B.11-6/11/pdata/1/peaks!
6 13:53:00 20250721-1330-B400_B.11-6 10 H1_Day16 m69065je + + - + + + + Ref JEK601_htd80_t4 Group Mills_D JEK601_htd80_t4 pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Mills_D/data/m69065je/nmr/20250721-1330-B400_B.11-6/10/pdata/1/peaks!, pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Mills_D/data/m69065je/nmr/20250721-1330-B400_B.11-6/10/pdata/1/peaks!
5 13:51:13 20250721-1330-B400_B.11-5 12 B11_NoCPD_Day m69065je - + - - - + + Ref JEK600_htd80_t4 Group Mills_D JEK600_htd80_t4 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/20250721-1330-B400_B.11-5/12/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/Mills_D/data/m69065je/nmr/20250721-1330-B400_B.11-5/12/pdata/1/peaks!
5 13:46:22 20250721-1330-B400_B.11-5 11 Si29_DEPT90_Day m69065je - + - - - + + Ref JEK600_htd80_t4 Group Mills_D JEK600_htd80_t4 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/20250721-1330-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/m69065je/nmr/20250721-1330-B400_B.11-5/11/pdata/1/peaks!
5 13:42:11 20250721-1330-B400_B.11-5 10 H1_Day16 m69065je + + - + + + + Ref JEK600_htd80_t4 Group Mills_D JEK600_htd80_t4 sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
4 13:36:19 20250721-1320-B400_B.11-1 40 H1_Day16 f85241bm + + - + + + + Ref BM938-1 Group Bures_J
3 13:30:13 20250721-1320-B400_B.11-1 30 H1_Day16 f85241bm + + - + + + + Ref BM938-8 Group Bures_J
2 13:23:01 20250721-1320-B400_B.11-1 20 H1_Day16 f85241bm + + - + + + + Ref BM938-7 Group Bures_J