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IconNMR Automation Run Status:
Day Experiments: 00:08
Busy Until: Wed 17:08
Night Experiments: 15:29

Setup List
Holder Status Name ExpNo Experiment User Time Title
1 Completed 20250917-1519-B500_B.14-1 10 N H1_Day Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 min 17 sec z16689fe 00:01:17 Ref DJP FE 015 Group Procter_D Pure! Yay!
1 Completed 20250917-1519-B500_B.14-1 11 C H1_COSY_Day COSY, ns = 2, sw = auto, centre (o1p) = auto, time = 2 min 38 sec z16689fe 00:05:04 Ref DJP FE 015 Group Procter_D Pure! Yay!
1 Submitted 20250917-1519-B500_B.14-1 12 n C13_CPD_Night256 Carbon, proton decoupled, ns = 256, sw = 255 ppm, centre (o1p) = 115 ppm, time = 13 min 22 sec z16689fe 00:13:22 Ref DJP FE 015 Group Procter_D Pure! Yay!
1 Submitted 20250917-1519-B500_B.14-1 13 n C13_DEPT135_Night DEPT135, proton decoupled, ns = 512, sw = 255 ppm, centre (o1p) = 115 ppm, time = 26 min 23 sec z16689fe 00:26:23 Ref DJP FE 015 Group Procter_D Pure! Yay!
1 Submitted 20250917-1519-B500_B.14-1 14 n H1_Night Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 min 17 sec z16689fe 00:01:17 Ref DJP FE 015 Group Procter_D Pure! Yay!
1 Submitted 20250917-1519-B500_B.14-1 15 c H1_C13_HMBC_Night Proton-Carbon HMBC, ns = 4, sw = auto x 240 ppm, centre (o1p) = auto, 100 ppm, time = 29 min 17 sec z16689fe 00:29:35 Ref DJP FE 015 Group Procter_D Pure! Yay!
1 Submitted 20250917-1519-B500_B.14-1 16 c H1_C13_HSQC_Night Proton-Carbon HSQC, ns = 4, sw = auto x 165 ppm, centre (o1p) = auto, 74 ppm, time = 28 min 9 sec z16689fe 00:19:46 Ref DJP FE 015 Group Procter_D Pure! Yay!
2 Completed 20250917-1523-B500_B.14-2 10 N H1_Day Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 min 17 sec b26045ab 00:01:17 Ref AT-ABO-02-478-P1 Group Trowbridge_A
3 Completed 20250917-1526-B500_B.14-3 10 N H1_Day Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 min 17 sec a15978el 00:01:17 Ref EL-04-028 CDCl3 Group James_M
4 Completed 20250917-1527-B500_B.14-4 10 N H1_Day Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 min 17 sec a15978el 00:01:17 Ref EL-04-028 DMSOd6 Group James_M
5 Completed 20250917-1528-B500_B.14-5 10 N H1_Day Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 min 17 sec a15978el 00:01:17 Ref EL-04-031-c Group James_M
6 Completed 20250917-1538-B500_B.14-6 10 N H1_Day Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 min 17 sec y37570lc 00:01:17 Ref lc E1197-2 CD3CN Group DeBo_G
6 Submitted 20250917-1538-B500_B.14-6 11 n H1_Night128 Proton, ns = 128, sw = 20 ppm, centre (o1p) = 6 ppm, time = 9 min 20 sec y37570lc 00:09:20 Ref lc E1197-2 CD3CN Group DeBo_G
6 Submitted 20250917-1538-B500_B.14-6 13 c H1_COSY_HiRes_Night COSY, ns = 2, sw = auto, centre (o1p) = auto, time = 37 min 10 sec y37570lc 00:40:20 Ref lc E1197-2 CD3CN Group DeBo_G
7 Submitted 20250917-1539-B500_B.14-7 10 n H1_Night Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 min 17 sec mbyxaac2 00:01:17 Ref DP-AC-173-173-CH Group Butterworth_S
7 Submitted 20250917-1539-B500_B.14-7 11 n C13_CPD_Night256 Carbon, proton decoupled, ns = 256, sw = 255 ppm, centre (o1p) = 115 ppm, time = 13 min 22 sec mbyxaac2 00:13:22 Ref DP-AC-173-173-CH Group Butterworth_S
7 Submitted 20250917-1539-B500_B.14-7 12 n C13_DEPT135_Night DEPT135, proton decoupled, ns = 512, sw = 255 ppm, centre (o1p) = 115 ppm, time = 26 min 23 sec mbyxaac2 00:26:23 Ref DP-AC-173-173-CH Group Butterworth_S
7 Submitted 20250917-1539-B500_B.14-7 13 c H1_COSY_HiRes_Night COSY, ns = 2, sw = auto, centre (o1p) = auto, time = 37 min 10 sec mbyxaac2 00:40:20 Ref DP-AC-173-173-CH Group Butterworth_S
7 Submitted 20250917-1539-B500_B.14-7 14 c H1_C13_HSQC_Night Proton-Carbon HSQC, ns = 4, sw = auto x 165 ppm, centre (o1p) = auto, 74 ppm, time = 28 min 9 sec mbyxaac2 00:19:46 Ref DP-AC-173-173-CH Group Butterworth_S
7 Submitted 20250917-1539-B500_B.14-7 15 c H1_C13_HMBC_Night Proton-Carbon HMBC, ns = 4, sw = auto x 240 ppm, centre (o1p) = auto, 100 ppm, time = 29 min 17 sec mbyxaac2 00:29:35 Ref DP-AC-173-173-CH Group Butterworth_S
8 Submitted 20250917-1554-B500_B.14-8 10 n H1_Night128 Proton, ns = 128, sw = 20 ppm, centre (o1p) = 6 ppm, time = 9 min 20 sec m09677nb 00:09:20 Ref 306 ii crude Group Greaney_M
9 Completed 20250917-1558-B500_B.14-9 10 N H1quant_Day Proton, Quantitative (p1=90deg, ds=0 ns = 1), sw = 20 ppm, centre (o1p) = 6 ppm. h18549ms 00:09:59 Ref JB_MS_02_036_1 Group Bures_J
10 Completed 20250917-1424-B500_B.14-10 10 N H1_Day Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 min 17 sec y52364mw 00:01:17 Ref GDB-MJ-158-P2 Group DeBo_G
10 Completed 20250917-1424-B500_B.14-10 11 C H1_COSY_Day COSY, ns = 2, sw = auto, centre (o1p) = auto, time = 2 min 38 sec y52364mw 00:05:04 Ref GDB-MJ-158-P2 Group DeBo_G
11 Completed 20250917-1424-B500_B.14-11 10 N H1_Day Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 min 17 sec y52364mw 00:01:17 Ref GDB-MJ-158-P3 Group DeBo_G
11 Completed 20250917-1424-B500_B.14-11 11 C H1_COSY_Day COSY, ns = 2, sw = auto, centre (o1p) = auto, time = 2 min 38 sec y52364mw 00:05:04 Ref GDB-MJ-158-P3 Group DeBo_G
12 Completed 20250917-1430-B500_B.14-12 10 N H1_Day Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 min 17 sec x73847lm 00:01:17 Ref IR-LJM-01-116 C2 F33 Group Riddell_I
13 Completed 20250917-1430-B500_B.14-13 10 N H1_Day Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 min 17 sec x73847lm 00:01:17 Ref IR-LJM-01-121 Group Riddell_I
14 Completed 20250917-1444-B500_B.14-14 10 N H1_Day Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 min 17 sec z40973rs 00:01:17 Ref gdb-rs-128 spot 1 (top) Group DeBo_G
14 Completed 20250917-1444-B500_B.14-14 11 C H1_COSY_Day COSY, ns = 2, sw = auto, centre (o1p) = auto, time = 2 min 38 sec z40973rs 00:05:04 Ref gdb-rs-128 spot 1 (top) Group DeBo_G
14 Completed 20250917-1444-B500_B.14-14 12 N C13_CPD_Day Carbon, proton decoupled, ns = 64, sw = 255 ppm, centre (o1p) = 115 ppm, time = 3 min 29 sec z40973rs 00:01:51 Ref gdb-rs-128 spot 1 (top) Group DeBo_G
15 Submitted 20250916-1613-B500_B.14-15 12 n H1_Night128 Proton, ns = 128, sw = 20 ppm, centre (o1p) = 6 ppm, time = 9 min 20 sec q85514th 00:09:20 Ref 00X fac Ir(CN-pmb)3 Group Greaney_M
15 Submitted 20250916-1613-B500_B.14-15 13 n C13_CPD_Night256 Carbon, proton decoupled, ns = 256, sw = 255 ppm, centre (o1p) = 115 ppm, time = 13 min 22 sec q85514th 00:13:22 Ref 00X fac Ir(CN-pmb)3 Group Greaney_M
16 Submitted 20250916-1613-B500_B.14-16 12 n H1_Night128 Proton, ns = 128, sw = 20 ppm, centre (o1p) = 6 ppm, time = 9 min 20 sec q85514th 00:09:20 Ref 00X mer Ir(CN-pmb)3 Group Greaney_M
16 Submitted 20250916-1613-B500_B.14-16 13 n C13_CPD_Night256 Carbon, proton decoupled, ns = 256, sw = 255 ppm, centre (o1p) = 115 ppm, time = 13 min 22 sec q85514th 00:13:22 Ref 00X mer Ir(CN-pmb)3 Group Greaney_M
18 Submitted 20250916-1600-B500_B.14-18 15 c H1_C13_HMBC_Night Proton-Carbon HMBC, ns = 4, sw = auto x 240 ppm, centre (o1p) = auto, 100 ppm, time = 29 min 17 sec h55599rb 00:29:35 Ref Rb-silylether Group Procter_D
18 Submitted 20250916-1600-B500_B.14-18 16 n F19_NoCPD_Night Fluorine, ns = 128, sw = 190 ppm, centre (o1p) = -100 ppm, time = 5 min 30 sec h55599rb 00:05:30 Ref Rb-silylether Group Procter_D
20 Submitted 20250917-0838-B500_B.14-20 11 n H1_Night128 Proton, ns = 128, sw = 20 ppm, centre (o1p) = 6 ppm, time = 9 min 20 sec m14269jw 00:36:55 Ref IR-JW-3097-Prog-AnthFC Group Riddell_I
20 Submitted 20250917-0838-B500_B.14-20 12 c H1_NOESY_US_Night NOESY, ns = 4, sw = auto, centre (o1p) = auto, time = 43 min 16 sec m14269jw 02:45:49 Ref IR-JW-3097-Prog-AnthFC Group Riddell_I
21 Completed 20250917-1619-B500_B.14-21 10 N H1_Day Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 min 17 sec a15978el 00:01:17 Ref EL-04-032 f17-37 Group James_M
23 Completed 20250917-1625-B500_B.14-23 10 N H1_Day Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 min 17 sec b32507dt 00:01:17 Ref dtg122a yellow vol Group Webb_S
24 Completed 20250917-1625-B500_B.14-24 10 N H1_Day Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 min 17 sec b32507dt 00:01:17 Ref dtg122b Group Webb_S
25 Completed 20250917-1627-B500_B.14-25 10 N H1_Day Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 min 17 sec y52364mw 00:01:17 Ref GDB-MJ-157 Group DeBo_G
26 Running 20250917-1629-B500_B.14-26 10 N H1_Day Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 min 17 sec e02956op 00:01:17 Ref GDB-OP0319B-1H Group DeBo_G
28 Submitted 20250917-1637-B500_B.14-28 10 N H1_Day Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 min 17 sec m30384it 00:01:17 Ref IT-01-003 Group Gibson_M
28 Submitted 20250917-1637-B500_B.14-28 11 n H1_Night128 Proton, ns = 128, sw = 20 ppm, centre (o1p) = 6 ppm, time = 9 min 20 sec m30384it 00:09:20 Ref IT-01-003 Group Gibson_M
28 Submitted 20250917-1637-B500_B.14-28 12 n C13_DEPT135_Night DEPT135, proton decoupled, ns = 512, sw = 255 ppm, centre (o1p) = 115 ppm, time = 26 min 23 sec m30384it 00:26:23 Ref IT-01-003 Group Gibson_M
28 Submitted 20250917-1637-B500_B.14-28 13 n H1_Night Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 min 17 sec m30384it 00:01:17 Ref IT-01-003 Group Gibson_M
28 Submitted 20250917-1637-B500_B.14-28 14 c H1_C13_HSQC_Night Proton-Carbon HSQC, ns = 4, sw = auto x 165 ppm, centre (o1p) = auto, 74 ppm, time = 28 min 9 sec m30384it 00:19:46 Ref IT-01-003 Group Gibson_M
28 Submitted 20250917-1637-B500_B.14-28 15 c H1_COSY_HiRes_Night COSY, ns = 2, sw = auto, centre (o1p) = auto, time = 37 min 10 sec m30384it 00:40:20 Ref IT-01-003 Group Gibson_M
29 Submitted 20250917-1641-B500_B.14-29 10 N H1_Day Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 min 17 sec j21190dp 00:01:17 Ref akdp62 dmso h1 Group Keerthi_A
29 Submitted 20250917-1641-B500_B.14-29 11 N C13_CPD_Day Carbon, proton decoupled, ns = 64, sw = 255 ppm, centre (o1p) = 115 ppm, time = 3 min 29 sec j21190dp 00:01:51 Ref akdp62 dmso c13 Group Keerthi_A
29 Submitted 20250917-1641-B500_B.14-29 12 n C13_Quant_CPD_Night Carbon, proton decoupled, ns = 64, sw = 255 ppm, centre (o1p) = 115 ppm, time = 1 hour 9 min 11 sec j21190dp 01:09:11 Ref akdp62 dmso c13 Group Keerthi_A
30 Submitted 20250917-1641-B500_B.14-30 10 N H1_Day Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 min 17 sec j21190dp 00:01:17 Ref akdp62 cdcl3 h1 Group Keerthi_A
30 Submitted 20250917-1641-B500_B.14-30 11 N C13_CPD_Day Carbon, proton decoupled, ns = 64, sw = 255 ppm, centre (o1p) = 115 ppm, time = 3 min 29 sec j21190dp 00:01:51 Ref akdp62 cdcl3 c13 Group Keerthi_A
30 Submitted 20250917-1641-B500_B.14-30 12 n C13_Quant_CPD_Night Carbon, proton decoupled, ns = 64, sw = 255 ppm, centre (o1p) = 115 ppm, time = 1 hour 9 min 11 sec j21190dp 01:09:11 Ref akdp62 cdcl3 c13 Group Keerthi_A
39 Submitted 20250917-0845-B500_B.14-39 10 n H1_Night Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 min 17 sec z86427mk 00:01:17 Ref MK-232-A Full Char Group Procter_D
39 Submitted 20250917-0845-B500_B.14-39 11 n C13_CPD_Night256 Carbon, proton decoupled, ns = 256, sw = 255 ppm, centre (o1p) = 115 ppm, time = 13 min 22 sec z86427mk 00:13:22 Ref MK-232-A Full Char Group Procter_D
39 Submitted 20250917-0845-B500_B.14-39 12 n C13_DEPT135_Night DEPT135, proton decoupled, ns = 512, sw = 255 ppm, centre (o1p) = 115 ppm, time = 26 min 23 sec z86427mk 00:26:23 Ref MK-232-A Full Char Group Procter_D
39 Submitted 20250917-0845-B500_B.14-39 13 c H1_COSY_HiRes_Night COSY, ns = 2, sw = auto, centre (o1p) = auto, time = 37 min 10 sec z86427mk 00:40:20 Ref MK-232-A Full Char Group Procter_D
39 Submitted 20250917-0845-B500_B.14-39 14 c H1_C13_HSQC_Night Proton-Carbon HSQC, ns = 4, sw = auto x 165 ppm, centre (o1p) = auto, 74 ppm, time = 28 min 9 sec z86427mk 00:19:46 Ref MK-232-A Full Char Group Procter_D
39 Submitted 20250917-0845-B500_B.14-39 15 c H1_C13_HMBC_Night Proton-Carbon HMBC, ns = 4, sw = auto x 240 ppm, centre (o1p) = auto, 100 ppm, time = 29 min 17 sec z86427mk 00:29:35 Ref MK-232-A Full Char Group Procter_D
History List
Holder Time Name ExpNo Experiment User Load Atma Spin Lock Shim Acq Proc Title Remarks
26 16:44:05 20250917-1629-B500_B.14-26 10 H1_Day e02956op - - - - - - - Ref GDB-OP0319B-1H Group DeBo_G
25 16:38:27 20250917-1627-B500_B.14-25 10 H1_Day y52364mw + + - + + + + Ref GDB-MJ-157 Group DeBo_G
24 16:32:20 20250917-1625-B500_B.14-24 10 H1_Day b32507dt + + - + + + + Ref dtg122b Group Webb_S
23 16:27:12 20250917-1625-B500_B.14-23 10 H1_Day b32507dt + + - + + + + Ref dtg122a yellow vol Group Webb_S
21 16:21:48 20250917-1619-B500_B.14-21 10 H1_Day a15978el + + - + + + + Ref EL-04-032 f17-37 Group James_M
19 16:15:19 20250917-1533-B500_B.14-19 10 H1_Day m30384it + + - + + + + Ref IT-01-003 Group Gibson_M
9 16:00:41 20250917-1558-B500_B.14-9 10 H1quant_Day h18549ms + + - + + + + Ref JB_MS_02_036_1 Group Bures_J
6 15:54:46 20250917-1538-B500_B.14-6 10 H1_Day y37570lc + + - + + + + Ref lc E1197-2 CD3CN Group DeBo_G
5 15:48:46 20250917-1528-B500_B.14-5 10 H1_Day a15978el + + - + + + + Ref EL-04-031-c Group James_M
4 15:43:36 20250917-1527-B500_B.14-4 10 H1_Day a15978el + + - + + + + Ref EL-04-028 DMSOd6 Group James_M
3 15:38:13 20250917-1526-B500_B.14-3 10 H1_Day a15978el + + - + + + + Ref EL-04-028 CDCl3 Group James_M
2 15:32:49 20250917-1523-B500_B.14-2 10 H1_Day b26045ab + + - + + + + Ref AT-ABO-02-478-P1 Group Trowbridge_A
1 15:26:38 20250917-1519-B500_B.14-1 11 H1_COSY_Day z16689fe - + - - - + + Ref DJP FE 015 Group Procter_D Pure! Yay!
1 15:19:55 20250917-1519-B500_B.14-1 10 H1_Day z16689fe + + - + + + + Ref DJP FE 015 Group Procter_D Pure! Yay!
17 15:13:57 20250917-1456-B500_B.14-17 10 H1_Day y37570lc + + - + + + + Ref lc E1197-1 CD3CN Group DeBo_G
14 15:10:56 20250917-1444-B500_B.14-14 12 C13_CPD_Day z40973rs - + - - - + + Ref gdb-rs-128 spot 1 (top) Group DeBo_G
14 15:04:44 20250917-1444-B500_B.14-14 11 H1_COSY_Day z40973rs - + - - - + + Ref gdb-rs-128 spot 1 (top) Group DeBo_G
14 14:58:57 20250917-1444-B500_B.14-14 10 H1_Day z40973rs + + - + + + + Ref gdb-rs-128 spot 1 (top) Group DeBo_G
13 14:53:55 20250917-1430-B500_B.14-13 10 H1_Day x73847lm + + - + + + + Ref IR-LJM-01-121 Group Riddell_I
12 14:48:30 20250917-1430-B500_B.14-12 10 H1_Day x73847lm + + - + + + + Ref IR-LJM-01-116 C2 F33 Group Riddell_I
11 14:42:20 20250917-1424-B500_B.14-11 11 H1_COSY_Day y52364mw - + - - - + + Ref GDB-MJ-158-P3 Group DeBo_G
11 14:37:34 20250917-1424-B500_B.14-11 10 H1_Day y52364mw + + - + + + + Ref GDB-MJ-158-P3 Group DeBo_G
10 14:31:03 20250917-1424-B500_B.14-10 11 H1_COSY_Day y52364mw - + - - - + + Ref GDB-MJ-158-P2 Group DeBo_G
10 14:25:17 20250917-1424-B500_B.14-10 10 H1_Day y52364mw + + - + + + + Ref GDB-MJ-158-P2 Group DeBo_G
9 14:19:55 20250917-1404-B500_B.14-9 10 H1_Day y38246dt + + - + + + + Ref GDB-DT-943-48h Group DeBo_G GDB-DT-943-48h
7 14:02:35 20250917-1357-B500_B.14-7 10 C13_CPD_Night256 z65435tw + + - + + + + Ref tw-1122-p-nmr-1h-cdcl3 Group Crisenza_G
6 13:57:15 20250917-1356-B500_B.14-6 10 H1_Day z65435tw + + - + + + + Ref tw-1170-c-1h-cdcl3 Group Crisenza_G
4 13:41:04 20250917-1259-B500_B.14-4 10 H1_Night128 m09677nb + + - + + + + Ref oxa mei rxn Group Greaney_M
7 13:35:21 20250917-1315-B500_B.14-7 10 H1_Day h91839em + + - + + + + Ref gc em 102 rep Group Crisenza_G
6 13:22:25 20250917-1301-B500_B.14-6 10 H1_Day y52364mw + + - + + + + Ref GDB-MJ-158-P3 Group DeBo_G
5 13:08:17 20250917-1301-B500_B.14-5 10 H1_Day y52364mw + + - + + + + Ref GDB-MJ-158-P2 Group DeBo_G
3 13:05:23 20250917-1257-B500_B.14-3 11 C13_CPD_Day f73629mn - + - - - + + Ref pmi Group Keerthi_A
3 12:59:01 20250917-1257-B500_B.14-3 10 H1_Day f73629mn + + - + + + + Ref pmi Group Keerthi_A
14 12:48:22 20250917-1247-B500_B.14-14 10 H1_Day e02956op + + - + + + + Ref GDB-OP0333-crude-16h_65C-1H Group DeBo_G
9 12:40:15 20250917-1239-B500_B.14-9 10 H1_Day w52164bc + + - + + + + Ref BC-11-112 crude Group James_M
2 12:12:41 20250917-1210-B500_B.14-2 10 H1_Day mbyxaac2 + + - + + + + Ref DP-AC-312 Group Butterworth_S
1 12:06:45 20250917-1206-B500_B.14-1 10 H1_Day n38871ln + + - + + + + Ref ln104 filter Group Larrosa_I
13 11:57:29 20250917-1144-B500_B.14-13 11 H1_ExtraWide_Day a17560mt - + - - - + + Ref REPW-MT104 Group Winpenny_R
13 11:51:58 20250917-1144-B500_B.14-13 10 H1_Wide_Day a17560mt + + - + + + + Ref REPW-MT104 Group Winpenny_R
12 11:46:56 20250917-1143-B500_B.14-12 10 H1_Day z40241jm + + - + + + + Ref DJP-JIM-7-077-2a Group Procter_D
10 11:40:34 20250917-1132-B500_B.14-9 20 H1_Day a74776dr + + - + + + + Ref DJP-DR-1-324 Group Procter_D
9 11:35:02 20250917-1132-B500_B.14-9 10 H1_Day a74776dr + + - + + + + Ref DJP-DR-1-311-repeat Group Procter_D
8 11:29:52 20250917-1128-B500_B.14-8 10 H1_Day mbyxaac2 + + - + + + + Ref DP-AC-OMs Group Butterworth_S
7 11:26:42 20250917-1110-B500_B.14-7 12 C13_DEPT135_Day q85514th - + - - - + + Ref 40XEN Group Greaney_M
7 11:23:48 20250917-1110-B500_B.14-7 11 C13_CPD_Day q85514th - + - - - + + Ref 40XEN Group Greaney_M
7 11:17:45 20250917-1110-B500_B.14-7 10 H1_Day q85514th + + - + + + + Ref 40XEN Group Greaney_M
5 11:12:36 20250917-1111-B500_B.14-5 10 H1_Day z86427mk + + - + + + + Ref MK-231-B C2 F10-12 Group Procter_D
3 11:09:36 20250917-1101-B500_B.14-3 11 C13_CPD_Day f73629mn - + - - - + + Ref ks172purefraction Group Keerthi_A
3 11:03:35 20250917-1101-B500_B.14-3 10 H1_Day f73629mn + + - + + + + Ref ks172purefraction Group Keerthi_A
4 10:45:24 20250917-1005-B500_B.14-4 11 H1_ExtraWide_Day a17560mt - + - - - + + Ref REPW-MT104 Group Winpenny_R
4 10:40:01 20250917-1005-B500_B.14-4 10 H1_Wide_Day a17560mt + + - + + + + Ref REPW-MT104 Group Winpenny_R
3 10:38:01 20250917-1013-B500_B.14-3 11 F19_NoCPD_Day c62220rg - + - - - + + Ref at-rg-5-4-p3 Group Trowbridge_A
3 10:32:24 20250917-1013-B500_B.14-3 10 H1_Day c62220rg + + - + + + + Ref at-rg-5-4-p3 Group Trowbridge_A
2 10:30:32 20250917-1013-B500_B.14-2 11 F19_NoCPD_Day c62220rg - + - - - + + Ref at-rg-5-4-product after trit Group Trowbridge_A
2 10:24:56 20250917-1013-B500_B.14-2 10 H1_Day c62220rg + + - + + + + Ref at-rg-5-4-product after trit Group Trowbridge_A
1 10:16:43 20250917-1001-B500_B.14-1 11 C13_CPD_Day h18549ms - + - - - + + Ref JB_MS_02_035_P2 Group Bures_J
1 10:02:08 20250917-1001-B500_B.14-1 10 H1quant_Day h18549ms + + - + + + + Ref JB_MS_02_035_P2 Group Bures_J
17 09:54:14 20250917-0949-B500_B.14-17 11 H1_Day a15978el - + - - - + + Ref EL-04-032-c Group James_M
17 09:49:43 20250917-0949-B500_B.14-17 10 H1_Wide_Day a15978el + + - + + + + Ref EL-04-032-c Group James_M
13 09:34:16 20250916-1841-B500_B.14-13 11 C13_CPD_Night256 z65435tw - + - - - + + Ref tw-1169-p-13c-cdcl3 Group Crisenza_G
13 09:27:51 20250916-1841-B500_B.14-13 10 H1_Night z65435tw + + - + + + + Ref tw-1169-p-1h-cdcl3 Group Crisenza_G
20 09:21:12 20250917-0838-B500_B.14-20 10 H1_Day m14269jw + + - + + + + Ref IR-JW-3097-Prog-AnthFC Group Riddell_I
4 09:17:57 20250917-0905-B500_B.14-4 11 C13_CPD_Day s77396es - + - - - + + Ref ETS15d Group Goodwin_C ETS15d_La(II)+CO_13C_nextMorning(17/09/25)
4 09:12:30 20250917-0905-B500_B.14-4 10 H1_Day s77396es + + - + + + + Ref ETS15d Group Goodwin_C ETS15d_La(II)+CO_1H_nextMorning(17/09/25)
45 09:07:30 20250917-0853-B500_B.14-45 10 H1_Day z86427mk + + - + + + + Ref MK-231-B F1-6 Group Procter_D
44 09:02:10 20250916-2008-B500_B.14-44 10 H1_Day w81612cw + + - + + + + Ref IL-CKW-PJ3-147 D Group Mehta_M
43 08:56:39 20250916-2008-B500_B.14-43 10 H1_Day w81612cw + + - + + + + Ref IL-CKW-PJ3-147 C Group Mehta_M
42 08:51:02 20250916-2008-B500_B.14-42 10 H1_Day w81612cw + + - + + + + Ref IL-CKW-PJ3-147 B Group Mehta_M
13 08:46:03 20250916-1841-B500_B.14-13 12 H1_Day z65435tw + + - + + + + Ref tw-1169-p-1h-cdcl3 Group Crisenza_G
12 08:39:37 20250916-1816-B500_B.14-12 10 H1_Day e02956op + + - + + + + Ref GDB-OP0319_check_250916 Group DeBo_G
18 08:18:07 20250916-1600-B500_B.14-18 14 H1_C13_HSQC_Night h55599rb - + - - - + + Ref Rb-silylether Group Procter_D
18 07:36:18 20250916-1600-B500_B.14-18 13 H1_COSY_HiRes_Night h55599rb - + - - - + + Ref Rb-silylether Group Procter_D
18 07:08:54 20250916-1600-B500_B.14-18 12 C13_DEPT135_Night h55599rb - + - - - + + Ref Rb-silylether Group Procter_D
18 06:53:16 20250916-1600-B500_B.14-18 11 C13_CPD_Night256 h55599rb - + - - - + + Ref Rb-silylether Group Procter_D
18 06:47:14 20250916-1600-B500_B.14-18 10 H1_Night h55599rb + + - + + + + Ref Rb-silylether Group Procter_D
17 06:15:40 20250916-1600-B500_B.14-17 15 H1_C13_HMBC_Night h55599rb - + - - - + + Ref RB-9-519.2B Group Procter_D
17 05:54:11 20250916-1600-B500_B.14-17 14 H1_C13_HSQC_Night h55599rb - + - - - + + Ref RB-9-519.2B Group Procter_D
17 05:12:13 20250916-1600-B500_B.14-17 13 H1_COSY_HiRes_Night h55599rb - + - - - + + Ref RB-9-519.2B Group Procter_D
17 04:44:49 20250916-1600-B500_B.14-17 12 C13_DEPT135_Night h55599rb - + - - - + + Ref RB-9-519.2B Group Procter_D
17 04:30:25 20250916-1600-B500_B.14-17 11 C13_CPD_Night256 h55599rb - + - - - + + Ref RB-9-519.2B Group Procter_D
17 04:24:33 20250916-1600-B500_B.14-17 10 H1_Night h55599rb + + - + + + + Ref RB-9-519.2B Group Procter_D
10 03:12:24 20250916-1544-B500_B.14-10 16 C13_Quant_CPD_Night j21190dp - + - - - + + Ref akdp60 sm c13 Group Keerthi_A
10 03:09:31 20250916-1544-B500_B.14-10 15 C13_CPD_Day j21190dp - + - - - + + Ref akdp60 sm c13 Group Keerthi_A
10 03:07:24 20250916-1544-B500_B.14-10 14 H1_Day j21190dp - + - - - + + Ref akdp60 sm h1 Group Keerthi_A
10 02:35:50 20250916-1544-B500_B.14-10 13 H1_C13_HMBC_Night z65435tw - + - - - + + Ref tw-1122-p-nmr-hmbc-cdcl3 Group Crisenza_G
10 02:33:42 20250916-1544-B500_B.14-10 12 H1_Night z65435tw - + - - - + + Ref tw-1122-p-nmr-13c-cdcl3 Group Crisenza_G
10 02:14:52 20250916-1544-B500_B.14-10 11 C13_CPD_Night256 z65435tw + + - + + + + Ref tw-1122-p-nmr-13c-cdcl3 Group Crisenza_G
8 00:56:21 20250916-1538-B500_B.14-8 11 H1_Night_1024 y38246dt + + - + + + + Ref GDB-DT-942-96h Group DeBo_G GDB-DT-942-96h
11 00:25:27 20250916-1425-B500_B.14-11 15 H1_C13_HMBC_US_Night y52364mw - + - - - + + Ref GDB-MJ-157-FULL Group DeBo_G
11 00:10:05 20250916-1425-B500_B.14-11 14 H1_C13_HSQC_US_Night y52364mw - + - - - + + Ref GDB-MJ-157-FULL Group DeBo_G
11 23:28:11 20250916-1425-B500_B.14-11 13 H1_COSY_HiRes_Night y52364mw - + - - - + + Ref GDB-MJ-157-FULL Group DeBo_G
11 23:26:04 20250916-1425-B500_B.14-11 12 H1_Night y52364mw - + - - - + + Ref GDB-MJ-157-FULL Group DeBo_G
11 22:32:10 20250916-1425-B500_B.14-11 11 C13_CPD_Night256 y52364mw - + - - - + + Ref GDB-MJ-157-FULL Group DeBo_G
11 22:17:35 20250916-1425-B500_B.14-11 10 H1_Night128 y52364mw + + - + + + + Ref GDB-MJ-157-FULL Group DeBo_G
23 21:46:02 20250915-1818-B500_B.14-23 15 H1_C13_HMBC_Night g23544jd - + - - - + + Ref MJJ-JDL-05-061-P Group James_M
23 21:24:29 20250915-1818-B500_B.14-23 14 H1_C13_HSQC_Night g23544jd - + - - - + + Ref MJJ-JDL-05-061-P Group James_M
23 20:42:34 20250915-1818-B500_B.14-23 13 H1_COSY_HiRes_Night g23544jd - + - - - + + Ref MJJ-JDL-05-061-P Group James_M
23 20:15:10 20250915-1818-B500_B.14-23 12 C13_DEPT135_Night g23544jd - + - - - + + Ref MJJ-JDL-05-061-P Group James_M
23 20:00:41 20250915-1818-B500_B.14-23 11 C13_CPD_Night256 g23544jd - + - - - + + Ref MJJ-JDL-05-061-P Group James_M
23 19:54:23 20250915-1818-B500_B.14-23 10 H1_Night g23544jd + + - + + + + Ref MJJ-JDL-05-061-P Group James_M
14 19:19:39 20250915-1721-B500_B.14-14 15 H1_C13_HMBC_Night h18549ms + + - + + + + Ref JB_MS_02_035_Char Group Bures_J
9 18:07:30 20250916-1757-B500_B.14-9 12 C13_Quant_CPD_Night j21190dp - + - - - + + Ref akdp60 crude c13 Group Keerthi_A
9 18:04:35 20250916-1757-B500_B.14-9 11 C13_CPD_Day j21190dp - + - - - + + Ref akdp60 crude c13 Group Keerthi_A
9 17:59:24 20250916-1757-B500_B.14-9 10 H1_Day j21190dp + + - + + + + Ref akdp60 crude h1 Group Keerthi_A
4 17:47:33 20250916-1651-B500_B.14-4 11 C13_CPD_Day s77396es - + - - - + + Ref ETs15c Group Goodwin_C ETS15c_CO+La(II)_evening_13C
4 17:41:36 20250916-1651-B500_B.14-4 10 H1_Day s77396es + + - + + + + Ref ETs15c Group Goodwin_C ETS15c_CO+La(II)_evening_1H
20 17:22:40 20250916-1645-B500_B.14-20 11 C13_CPD_Day h18549ms + + - + + + + Ref JB_MS_02_035_P1 Group Bures_J
27 17:17:52 20250916-1654-B500_B.14-27 10 H1_Day y58410zl + + - + + + + Ref PVA100 Group Gibson_M
26 17:12:43 20250916-1653-B500_B.14-26 10 H1_Day y58410zl + + - + + + + Ref PVA50 Group Gibson_M
25 17:07:12 20250916-1652-B500_B.14-25 10 H1_Day y58410zl + + - + + + + Ref CTA Group Gibson_M
21 17:01:05 20250916-1658-B500_B.14-21 10 H1_Day g16660ml + + - + + + + Ref djp-muze Group Procter_D
20 16:46:17 20250916-1645-B500_B.14-20 10 H1quant_Day h18549ms + + - + + + + Ref JB_MS_02_035_P1 Group Bures_J
41 16:33:03 20250916-1617-B500_B.14-41 10 H1_Day w81612cw + + - + + + + Ref IL-CKW-PJ3-147 A Group Mehta_M
16 16:29:16 20250916-1613-B500_B.14-16 11 C13_CPD_Day q85514th - + - - - + + Ref 00X mer Ir(CN-pmb)3 Group Greaney_M
16 16:23:22 20250916-1613-B500_B.14-16 10 H1_Day q85514th + + - + + + + Ref 00X mer Ir(CN-pmb)3 Group Greaney_M
15 16:20:27 20250916-1613-B500_B.14-15 11 C13_CPD_Day q85514th - + - - - + + Ref 00X fac Ir(CN-pmb)3 Group Greaney_M
15 16:15:05 20250916-1613-B500_B.14-15 10 H1_Day q85514th + + - + + + + Ref 00X fac Ir(CN-pmb)3 Group Greaney_M
12 16:03:14 20250916-1602-B500_B.14-12 10 H1_Day z40241jm + + - + + + + Ref DJP-JIM-7-087-1a Group Procter_D
10 15:44:37 20250916-1544-B500_B.14-10 10 H1_Day z65435tw + + - + + + + Ref tw-1122-p-nmr-1h-cdcl3 Group Crisenza_G
8 15:38:31 20250916-1538-B500_B.14-8 10 H1_Day y38246dt + + - + + + + Ref GDB-DT-942-96h Group DeBo_G GDB-DT-942-96h
6 15:27:28 20250916-1525-B500_B.14-6 10 H1_Day y38246dt + + - + + + + Ref GDB-DT-943-24h Group DeBo_G GDB-DT-943-24h
5 15:22:01 20250916-1500-B500_B.14-5 10 H1_Day mmapqaa2 + + - + + + + Ref Anisole_Dmac aa pb Group Budd_P
4 15:19:01 20250916-1451-B500_B.14-4 11 C13_CPD_Day s77396es - + - - - + + Ref ETS15b Group Goodwin_C ETS15b_La(II)+CO_13C_direct_afterAddition sref: reference peak not found default calibration done
4 15:13:36 20250916-1451-B500_B.14-4 10 H1_Day s77396es + + - + + + + Ref ETS15b Group Goodwin_C ETS15b_La(II)+CO_1H_direct_afterAddition
40 15:11:40 20250916-1505-B500_B.14-40 11 F19_NoCPD_Day c62220rg - + - - - + + Ref at-rg-5-4-p1 Group Trowbridge_A
40 15:05:50 20250916-1505-B500_B.14-40 10 H1_Day c62220rg + + - + + + + Ref at-rg-5-4-p1 Group Trowbridge_A
38 14:59:46 20250916-1449-B500_B.14-38 10 H1_Day g16660ml + + - + + + + Ref djp-muze Group Procter_D
37 14:54:24 20250916-1447-B500_B.14-37 10 H1_Day h91839em + + - + + + + Ref GC EM 115C Group Crisenza_G
36 14:47:02 20250916-1446-B500_B.14-36 10 H1_Day h91839em + + - + + + + Ref GC EM 114 C Group Crisenza_G
10 14:31:53 20250916-1424-B500_B.14-10 10 H1_Day y52364mw + + - + + + + Ref GDB-MJ-158-P4 Group DeBo_G
9 14:26:16 20250916-1416-B500_B.14-9 10 H1_Day z86427mk + + - + + + + Ref MK-231-B F4 Group Procter_D
8 14:15:50 20250915-1944-B500_B.14-6 31 F19_NoCPD_Night m09677nb + + - + + + + Ref phnh2 zk new Group Greaney_M
3 14:10:10 20250916-1407-B500_B.14-3 10 H1_Day z86427mk + + - + + + + Ref MK-231-B F34-38 Group Procter_D
2 14:07:10 20250916-1335-B500_B.14-2 11 C13_CPD_Day q49270na - + - - - + + Ref na-53 Group Greaney_M
2 14:01:11 20250916-1335-B500_B.14-2 10 H1_Day q49270na + + - + + + + Ref na-53 Group Greaney_M
1 13:55:49 20250916-1207-B500_B.14-1 10 H1_Day m09677nb + + - + + + + Ref free py Group Greaney_M
16 13:50:03 20250916-1347-B500_B.14-16 10 H1_Day z40241jm + + - + + + + Ref DJP-JIM-7-088-1a Group Procter_D
15 13:43:46 20250916-1327-B500_B.14-15 10 H1_Day w52164bc + + - + + + + Ref BC-11-112 pyrene 150 C Group James_M
13 13:41:49 20250916-1325-B500_B.14-13 11 F19_NoCPD_Day w52164bc - + - - - + + Ref BC-11-112 F29-38 Group James_M
13 13:34:51 20250916-1325-B500_B.14-13 10 H1_Day w52164bc + + - + + + + Ref BC-11-112 F29-38 Group James_M
12 13:32:57 20250916-1324-B500_B.14-12 11 F19_NoCPD_Day w52164bc - + - - - + + Ref BC-11-112 F2-12 Group James_M
12 13:26:29 20250916-1324-B500_B.14-12 10 H1_Day w52164bc + + - + + + + Ref BC-11-112 F2-12 Group James_M
11 13:21:50 20250916-1315-B500_B.14-11 10 H1_Day m14269jw + + - + + + + Ref IR-JW-SulfCoreBacth2-15thSep Group Riddell_I
10 13:15:38 20250916-1314-B500_B.14-10 10 H1_Day m14269jw + + - + + + + Ref IR-JW-SulfCoreBacth1-15thSep Group Riddell_I sref: reference peak not found default calibration done
8 09:59:07 20250915-1944-B500_B.14-6 30 H1_Night128 m09677nb + + - + + + + Ref phnh2 zk new Group Greaney_M Automation was stopped by user
7 09:52:03 20250915-1944-B500_B.14-6 21 F19_NoCPD_Night m09677nb - + - - - + + Ref phnh2 zk old Group Greaney_M
7 09:37:25 20250915-1944-B500_B.14-6 20 H1_Night128 m09677nb + + - + + + + Ref phnh2 zk old Group Greaney_M
9 09:31:05 20250916-0927-B500_B.14-9 10 H1_Day a17560mt + + - + + + + Ref REPW-MT081d Group Winpenny_R
6 09:19:39 20250915-1944-B500_B.14-6 11 F19_NoCPD_Night m09677nb + + - + + + + Ref free py Group Greaney_M
9 09:12:58 20250916-0904-B500_B.14-9 10 H1_Day c62220rg + + - + + + + Ref at-rg-5-10-r1 Group Trowbridge_A
6 08:58:19 20250915-1944-B500_B.14-6 10 H1_Night128 m09677nb + + - + + + + Ref free py Group Greaney_M
14 08:36:50 20250915-1721-B500_B.14-14 14 H1_C13_HSQC_Night h18549ms - + - - - + + Ref JB_MS_02_035_Char Group Bures_J
14 08:09:16 20250915-1721-B500_B.14-14 13 C13_CPD_Night256 h18549ms - + - - - + + Ref JB_MS_02_035_Char Group Bures_J
14 07:27:19 20250915-1721-B500_B.14-14 12 H1_COSY_HiRes_Night h18549ms - + - - - + + Ref JB_MS_02_035_Char Group Bures_J
14 07:17:10 20250915-1721-B500_B.14-14 11 H1_Night h18549ms - + - - - + + Ref JB_MS_02_035_Char Group Bures_J
14 06:53:09 20250915-1721-B500_B.14-14 10 H1quant_Day h18549ms + + - + + + + Ref JB_MS_02_035_Char Group Bures_J
25 06:21:41 20250915-1534-B500_B.14-25 17 H1_C13_HMBC_Night z86427mk - + - - - + + Ref MK-230 Group Procter_D
25 06:00:10 20250915-1534-B500_B.14-25 16 H1_C13_HSQC_Night z86427mk - + - - - + + Ref MK-230 Group Procter_D
25 05:18:17 20250915-1534-B500_B.14-25 15 H1_COSY_HiRes_Night z86427mk - + - - - + + Ref MK-230 Group Procter_D
25 04:50:53 20250915-1534-B500_B.14-25 14 C13_DEPT135_Night z86427mk - + - - - + + Ref MK-230 Group Procter_D
25 04:36:28 20250915-1534-B500_B.14-25 13 C13_CPD_Night256 z86427mk - + - - - + + Ref MK-230 Group Procter_D
25 04:30:04 20250915-1534-B500_B.14-25 12 H1_Night z86427mk + + - + + + + Ref MK-230 Group Procter_D
13 03:58:33 20250915-1437-B500_B.14-13 16 H1_C13_HMBC_Night y38246dt - + - - - + + Ref GDB-DT-938 Group DeBo_G GDB-DT-938
13 03:37:03 20250915-1437-B500_B.14-13 15 H1_C13_HSQC_Night y38246dt - + - - - + + Ref GDB-DT-938 Group DeBo_G GDB-DT-938
13 02:55:13 20250915-1437-B500_B.14-13 14 H1_COSY_HiRes_Night y38246dt - + - - - + + Ref GDB-DT-938 Group DeBo_G GDB-DT-938
13 02:27:48 20250915-1437-B500_B.14-13 13 C13_DEPT135_Night y38246dt - + - - - + + Ref GDB-DT-938 Group DeBo_G GDB-DT-938
13 02:13:24 20250915-1437-B500_B.14-13 12 C13_CPD_Night256 y38246dt - + - - - + + Ref GDB-DT-938 Group DeBo_G GDB-DT-938
13 02:07:51 20250915-1437-B500_B.14-13 11 H1_Night y38246dt + + - + + + + Ref GDB-DT-938 Group DeBo_G GDB-DT-938
5 01:53:26 20250915-1321-B500_B.14-4 21 C13_CPD_Night256 m09677nb - + - - - + + Ref 4ph sequential Group Greaney_M
5 01:39:39 20250915-1321-B500_B.14-4 20 H1_Night128 m09677nb + + - + + + + Ref 4ph sequential Group Greaney_M
4 01:25:14 20250915-1321-B500_B.14-4 11 C13_CPD_Night256 m09677nb - + - - - + + Ref 4me sequential Group Greaney_M
4 01:10:18 20250915-1321-B500_B.14-4 10 H1_Night128 m09677nb + + - + + + + Ref 4me sequential Group Greaney_M
34 00:38:48 20250915-1205-B500_B.14-34 16 H1_C13_HMBC_Night z86427mk - + - - - + + Ref MK-232-B Full Char Group Procter_D
34 00:17:15 20250915-1205-B500_B.14-34 15 H1_C13_HSQC_Night z86427mk - + - - - + + Ref MK-232-B Full Char Group Procter_D
34 23:35:21 20250915-1205-B500_B.14-34 14 H1_COSY_HiRes_Night z86427mk - + - - - + + Ref MK-232-B Full Char Group Procter_D
34 23:07:56 20250915-1205-B500_B.14-34 13 C13_DEPT135_Night z86427mk - + - - - + + Ref MK-232-B Full Char Group Procter_D
34 22:52:53 20250915-1205-B500_B.14-34 12 C13_CPD_Night256 z86427mk - + - - - + + Ref MK-232-B Full Char Group Procter_D
34 22:46:04 20250915-1205-B500_B.14-34 11 H1_Night z86427mk + + - + + + + Ref MK-232-B Full Char Group Procter_D
39 22:14:36 20250915-1023-B500_B.14-39 16 H1_C13_HMBC_Night b59259yj - + - - - + + Ref MTYJAStage11 Group Turner_M
39 21:53:03 20250915-1023-B500_B.14-39 15 H1_C13_HSQC_Night b59259yj - + - - - + + Ref MTYJAStage11 Group Turner_M
39 21:11:10 20250915-1023-B500_B.14-39 14 H1_COSY_HiRes_Night b59259yj - + - - - + + Ref MTYJAStage11 Group Turner_M
39 20:43:46 20250915-1023-B500_B.14-39 13 C13_DEPT135_Night b59259yj - + - - - + + Ref MTYJAStage11 Group Turner_M
39 20:29:21 20250915-1023-B500_B.14-39 12 C13_CPD_Night256 b59259yj - + - - - + + Ref MTYJAStage11 Group Turner_M
39 20:23:31 20250915-1023-B500_B.14-39 11 H1_Night b59259yj + + - + + + + Ref MTYJAStage11 Group Turner_M
38 19:52:01 20250915-1022-B500_B.14-38 16 H1_C13_HMBC_Night b59259yj - + - - - + + Ref MTYJAstage10 Group Turner_M
38 19:30:29 20250915-1022-B500_B.14-38 15 H1_C13_HSQC_Night b59259yj - + - - - + + Ref MTYJAstage10 Group Turner_M
38 18:48:35 20250915-1022-B500_B.14-38 14 H1_COSY_HiRes_Night b59259yj - + - - - + + Ref MTYJAstage10 Group Turner_M
38 18:21:11 20250915-1022-B500_B.14-38 13 C13_DEPT135_Night b59259yj - + - - - + + Ref MTYJAstage10 Group Turner_M
38 18:06:45 20250915-1022-B500_B.14-38 12 C13_CPD_Night256 b59259yj - + - - - + + Ref MTYJAstage10 Group Turner_M
38 18:00:37 20250915-1022-B500_B.14-38 11 H1_Night b59259yj + + - + + + + Ref MTYJAstage10 Group Turner_M
52 17:41:20 20250915-1735-B500_B.14-52 11 H1_ExtraWide_Day a17560mt - + - - - + + Ref REPW-MT083c dry Group Winpenny_R
52 17:35:54 20250915-1735-B500_B.14-52 10 H1_Wide_Day a17560mt + + - + + + + Ref REPW-MT083c dry Group Winpenny_R
1 17:26:35 20250915-1717-B500_B.14-1 10 H1_Day z16689fe x - - - - - - Ref DJP FE 008 Group Procter_D Post-distillation Sample Changer: Error: SKIP_SAMPLE :: Error: No sample in position 1
28 17:20:58 20250915-1712-B500_B.14-28 10 H1_Day q85514th + + - + + + + Ref 201TPS- SM Group Greaney_M
27 17:17:59 20250915-1711-B500_B.14-27 11 C13_CPD_Day q85514th - + - - - + + Ref 5801TPS Group Greaney_M
27 17:12:10 20250915-1711-B500_B.14-27 10 H1_Day q85514th + + - + + + + Ref 5801TPS Group Greaney_M
2 16:49:13 20250915-1637-B500_B.14-2 11 F19_NoCPD_Day w52164bc - + - - - + + Ref BC-11-105 crude Group James_M
2 16:43:17 20250915-1637-B500_B.14-2 10 H1_Day w52164bc + + - + + + + Ref BC-11-105 crude Group James_M
1 16:36:52 20250915-1616-B500_B.14-1 10 H1_Day z16689fe + + - + + + + Ref DJP FE 008 Group Procter_D Post-distillation
31 16:34:55 20250915-1623-B500_B.14-31 11 F19_NoCPD_Day mbdxwen2 - + - - - + + Ref EN-PtpCF3 in PS Group Natrajan_L
31 16:29:54 20250915-1623-B500_B.14-31 10 H1_Day mbdxwen2 + + - + + + + Ref EN-PtpCF3 in PS Group Natrajan_L
30 16:24:29 20250915-1623-B500_B.14-30 10 H1_Day mbdxwen2 + + - + + + + Ref EN-PtOHCHeck Group Natrajan_L
28 16:19:06 20250915-1612-B500_B.14-28 10 H1_Day z86427mk + + - + + + + Ref MK-F18 Group Procter_D
27 16:13:44 20250915-1612-B500_B.14-27 10 H1_Day z86427mk + + - + + + + Ref MK-F14 Group Procter_D
25 15:47:26 20250915-1534-B500_B.14-25 11 F19_NoCPD_Day z86427mk - + - - - + + Ref MK-230 Group Procter_D
25 15:40:52 20250915-1534-B500_B.14-25 10 H1_Day z86427mk + + - + + + + Ref MK-230 Group Procter_D
24 15:35:13 20250915-1534-B500_B.14-24 10 H1_Day z86427mk + + - + + + + Ref MK-232-A F15-17 Group Procter_D
22 15:17:12 20250915-1516-B500_B.14-22 10 H1_Day b26045ab + + - + + + + Ref AT-ABO-02-472-iso Group Trowbridge_A
21 15:10:49 20250915-1442-B500_B.14-20 20 H1_Day z65435tw + + - + + + + Ref tw-1164-c-1h-cdcl3 Group Crisenza_G
20 15:05:14 20250915-1442-B500_B.14-20 10 H1_Day z65435tw + + - + + + + Ref tw-1163-c-1h-cdcl3 Group Crisenza_G
17 15:00:08 20250915-1451-B500_B.14-17 10 H1_Day g16660ml + + - + + + + Ref djp-muze Group Procter_D
16 14:54:16 20250915-1439-B500_B.14-14 30 H1_Day z65435tw + + - + + + + Ref tw-1162-c-1h-cdcl3 Group Crisenza_G
15 14:49:09 20250915-1439-B500_B.14-14 20 H1_Day z65435tw + + - + + + + Ref tw-1161-c-1h-cdcl3 Group Crisenza_G
14 14:42:14 20250915-1439-B500_B.14-14 10 H1_Day z65435tw + + - + + + + Ref tw-1160-c-1h-cdcl3 Group Crisenza_G
13 14:37:37 20250915-1437-B500_B.14-13 10 H1_Day y38246dt + + - + + + + Ref GDB-DT-938 Group DeBo_G GDB-DT-938
10 14:17:43 20250915-1417-B500_B.14-10 10 H1_Day y38246dt + + - + + + + Ref GDB-DT-943-3h Group DeBo_G GDB-DT-943-3h
8 14:07:10 20250915-1404-B500_B.14-8 10 H1_Day s77396es + + - + + + + Ref ETS12 Group Goodwin_C ETS12_trip2C6H3N3_1H_before_dried
1 14:01:08 20250915-1400-B500_B.14-1 10 H1_Day z16689fe + + - + + + + Ref DJP FE 008 Group Procter_D post-column, second fraction
35 13:42:44 20250915-1212-B500_B.14-35 10 C13_CPD_Night256 m09677nb + + - + + + + Ref ome cf2cl Group Greaney_M
3 13:37:21 20250915-1317-B500_B.14-3 10 H1_Day n11507nv + + - + + + + Ref NVZ-1-1_control Group Shaver_M CDCl3_blank_15-9-2025
2 13:32:00 20250915-1316-B500_B.14-2 10 H1_Day n11507nv + + - + + + + Ref NVZ-1-1 Group Shaver_M NVZ-1-1 Anth_MPA_15-9-2025
1 13:26:22 20250915-1312-B500_B.14-1 10 H1_Day z16689fe + + - + + + + Ref DJP FE 008 Group Procter_D post-column, first fraction
46 13:20:13 20250915-1245-B500_B.14-46 10 H1_Day y37570lc + + - + + + + Ref lc E1196 CDCl3 Group DeBo_G
45 13:14:02 20250915-1245-B500_B.14-45 10 H1_Day y37570lc + + - + + + + Ref lc E1196 Group DeBo_G
44 13:07:42 20250915-1228-B500_B.14-44 10 H1_Day w52164bc + + - + + + + Ref BC-11-108 P1 Group James_M
43 13:01:55 20250915-1245-B500_B.14-43 10 H1_Day y37570lc + + - + + + + Ref lc E1195 Group DeBo_G
42 12:56:53 20250912-1248-B500_B.14-42 16 H1_Day j40457bh + + - + + + + Ref bh ah 52 c1 fr50+ Group Trowbridge_A
41 12:51:45 20250915-1236-B500_B.14-41 10 H1_Day j40457bh + + - + + + + Ref bh ah 55 Group Trowbridge_A
40 12:46:10 20250912-1244-B500_B.14-40 14 H1_Day w52164bc + + - + + + + Ref BC-11-110 3-Py Group James_M
37 12:40:21 20250915-1223-B500_B.14-37 10 H1_Day w52164bc + + - + + + + Ref BC-11-111 indazole Group James_M
36 12:38:21 20250915-1223-B500_B.14-36 11 F19_NoCPD_Day w52164bc - + - - - + + Ref BC-11-100 crude Group James_M
36 12:32:51 20250915-1223-B500_B.14-36 10 H1_Day w52164bc + + - + + + + Ref BC-11-100 crude Group James_M
34 12:27:33 20250915-1205-B500_B.14-34 10 H1_Day z86427mk + + - + + + + Ref MK-232-B Full Char Group Procter_D
33 12:04:00 20250915-1134-B500_B.14-33 12 H1_COSY_Day h18549ms + + - + + + + Ref JB_MS_02_032_W Group Bures_J
1 11:58:27 20250915-1142-B500_B.14-1 10 H1_Day z16689fe + + - + + + + Ref DJP FE 008 (crude) Group Procter_D
34 11:53:01 20250915-1149-B500_B.14-34 10 H1_Day z65435tw + + - + + + + Ref tw-1140-c-1h-cdcl3 Group Crisenza_G
33 11:50:57 20250915-1134-B500_B.14-33 11 H1_Day h18549ms - + - - - + + Ref JB_MS_02_032_W Group Bures_J
33 11:35:22 20250915-1134-B500_B.14-33 10 H1quant_Day h18549ms + + - + + + + Ref JB_MS_02_032_W Group Bures_J
27 11:28:31 20250915-1113-B500_B.14-27 10 H1_Day z86427mk + + - + + + + Ref MK-231-A CF-B5 Group Procter_D
26 11:23:07 20250915-1113-B500_B.14-26 10 H1_Day z86427mk + + - + + + + Ref MK-231-A CF-B4 Group Procter_D
25 11:18:01 20250915-1112-B500_B.14-25 10 H1_Day z86427mk + + - + + + + Ref MK-231-A CF-B3 Group Procter_D
24 11:12:45 20250915-1107-B500_B.14-24 10 H1_Day mbdxrbj2 + + - + + + + Ref BJ_lut-dist Group Procter_D
23 10:58:32 20250915-1058-B500_B.14-23 10 H1quant_Day h18549ms + + - + + + + Ref JB_MS_02_035_P Group Bures_J
41 10:40:09 20250915-1039-B500_B.14-41 10 H1_Day z40241jm + + - + + + + Ref DJP-JIM-7-086-1a Group Procter_D
39 10:29:18 20250915-1023-B500_B.14-39 10 H1_Day b59259yj + + - + + + + Ref MTYJAStage11 Group Turner_M
38 10:23:46 20250915-1022-B500_B.14-38 10 H1_Day b59259yj + + - + + + + Ref MTYJAstage10 Group Turner_M
51 10:17:03 20250915-1016-B500_B.14-51 10 H1_Day a15978el + + - + + + + Ref EL-04-025-SM Group James_M
3 09:57:49 20250915-0922-B500_B.14-3 10 C13_CPD_Night256 z16689fe + + - + + + + Ref DJP FE 012 (SM) Group Procter_D
2 09:40:12 20250915-0922-B500_B.14-2 10 C13_CPD_Night256 z16689fe + + - + + + + Ref DJP FE 011 (SM) Group Procter_D
1 09:22:16 20250915-0921-B500_B.14-1 10 C13_CPD_Night256 z16689fe + + - + + + + Ref DJP FE 010 (SM) Group Procter_D
3 09:16:05 20250915-0904-B500_B.14-3 10 H1_Day z16689fe + + - + + + + Ref DJP FE 012 (SM) Group Procter_D
2 09:10:23 20250915-0904-B500_B.14-2 10 H1_Day z16689fe + + - + + + + Ref DJP FE 011 (SM) Group Procter_D
1 09:04:05 20250915-0903-B500_B.14-1 10 H1_Day z16689fe + + - + + + + Ref DJP FE 010 (SM) Group Procter_D
41 07:49:31 20250915-0748-B500_B.14-41 10 H1_Night128 m14269jw + + - + + + + Ref IR-JW-3097-Complex Group Riddell_I
1 15:21:19 20250912-1803-B500_B.14-1 10 H1_1024_Night y37570lc + + - + + + + Ref lc618-1 polymer E1192 D3CN Group DeBo_G
1 02:21:03 20250912-1803-B500_B.14-1 10 H1_1024_Night y37570lc x - - - - - - Ref lc618-1 polymer E1192 D3CN Group DeBo_G
16 01:03:34 20250912-1756-B500_B.14-16 10 H1_Night128 z40973rs + + - + + + + Ref gdb-rs-127 squaramide MeOH wash Group DeBo_G
15 23:46:23 20250912-1755-B500_B.14-15 11 H1_COSY_NS32_Night z40973rs - + - - - + + Ref gdb-rs-126 HMAM MeOH wash Group DeBo_G
15 22:28:12 20250912-1755-B500_B.14-15 10 H1_Night128 z40973rs + + - + + + + Ref gdb-rs-126 HMAM MeOH wash Group DeBo_G
14 22:13:48 20250912-1746-B500_B.14-14 11 C13_CPD_Night256 h91839em - + - - - + + Ref GC EM 111 Group Crisenza_G
14 22:00:11 20250912-1746-B500_B.14-14 10 H1_Night128 h91839em + + - + + + + Ref GC EM 111 Group Crisenza_G
27 21:38:42 20250912-1327-B500_B.14-26 24 H1_C13_HSQC_Night s77396es - + - - - + + Ref ETS09b Group Goodwin_C ETS09b_Trip2C6H3I_HSQC
27 21:11:02 20250912-1327-B500_B.14-26 23 C13_DEPT135_Night s77396es - + - - - + + Ref ETS09b Group Goodwin_C ETS09b_Trip2C6H3I_DEPT135
27 20:56:38 20250912-1327-B500_B.14-26 22 C13_CPD_Night256 s77396es - + - - - + + Ref ETS09b Group Goodwin_C ETS09b_Trip2C6H3I_13C
27 20:51:05 20250912-1327-B500_B.14-26 21 H1_Night s77396es + + - + + + + Ref ETS09b Group Goodwin_C ETS09b_Trip2C6H3I_1H
26 20:19:34 20250912-1327-B500_B.14-26 16 H1_C13_HMBC_Night s77396es - + - - - + + Ref ETS13a Group Goodwin_C ETS13_La(II)=S8_GBreaction_HMBC
26 19:58:00 20250912-1327-B500_B.14-26 15 H1_C13_HSQC_Night s77396es - + - - - + + Ref ETS13a Group Goodwin_C ETS13_La(II)=S8_GBreaction_HSQC
26 19:16:06 20250912-1327-B500_B.14-26 14 H1_COSY_HiRes_Night s77396es - + - - - + + Ref ETS13a Group Goodwin_C ETS13_La(II)=S8_GBreaction_1H_COSY
26 18:48:39 20250912-1327-B500_B.14-26 13 C13_DEPT135_Night s77396es - + - - - + + Ref ETS13a Group Goodwin_C ETS13_La(II)=S8_GBreaction_13C_DEPT135
26 18:34:14 20250912-1327-B500_B.14-26 12 C13_CPD_Night256 s77396es - + - - - + + Ref ETS13a Group Goodwin_C ETS13_La(II)=S8_GBreaction_13C
26 18:27:51 20250912-1327-B500_B.14-26 11 H1_Night s77396es + + - + + + + Ref ETS13a Group Goodwin_C ETS13_La(II)=S8_GBreaction_1H
7 17:56:22 20250912-1517-B500_B.14-7 15 H1_C13_HMBC_Night p36475ys - + - - - + + Ref YS-08-632-P1 Group Butterworth_S
7 17:34:47 20250912-1517-B500_B.14-7 14 H1_C13_HSQC_Night p36475ys - + - - - + + Ref YS-08-632-P1 Group Butterworth_S
7 16:52:54 20250912-1517-B500_B.14-7 13 H1_COSY_HiRes_Night p36475ys - + - - - + + Ref YS-08-632-P1 Group Butterworth_S
7 16:25:29 20250912-1517-B500_B.14-7 12 C13_DEPT135_Night p36475ys - + - - - + + Ref YS-08-632-P1 Group Butterworth_S
7 16:11:05 20250912-1517-B500_B.14-7 11 C13_CPD_Night256 p36475ys - + - - - + + Ref YS-08-632-P1 Group Butterworth_S
7 16:05:10 20250912-1517-B500_B.14-7 10 H1_Night p36475ys + + - + + + + Ref YS-08-632-P1 Group Butterworth_S
42 15:33:41 20250912-1248-B500_B.14-42 15 H1_C13_HMBC_Night mbyxaac2 - + - - - + + Ref DP-AC-Teathered Mesylate Group Butterworth_S
42 15:12:11 20250912-1248-B500_B.14-42 14 H1_C13_HSQC_Night mbyxaac2 - + - - - + + Ref DP-AC-Teathered Mesylate Group Butterworth_S
42 14:30:17 20250912-1248-B500_B.14-42 13 H1_COSY_HiRes_Night mbyxaac2 - + - - - + + Ref DP-AC-Teathered Mesylate Group Butterworth_S
42 14:02:50 20250912-1248-B500_B.14-42 12 C13_DEPT135_Night mbyxaac2 - + - - - + + Ref DP-AC-Teathered Mesylate Group Butterworth_S
42 13:48:26 20250912-1248-B500_B.14-42 11 C13_CPD_Night256 mbyxaac2 - + - - - + + Ref DP-AC-Teathered Mesylate Group Butterworth_S
42 13:42:20 20250912-1248-B500_B.14-42 10 H1_Night mbyxaac2 + + - + + + + Ref DP-AC-Teathered Mesylate Group Butterworth_S
41 13:19:03 20250912-1246-B500_B.14-41 16 H1_NOESY_Night mbyxaac2 - + - - - + + Ref DP-AC-302-CH-NOESY Group Butterworth_S
41 12:47:33 20250912-1246-B500_B.14-41 15 H1_C13_HMBC_Night mbyxaac2 - + - - - + + Ref DP-AC-302-CH-NOESY Group Butterworth_S
41 12:26:04 20250912-1246-B500_B.14-41 14 H1_C13_HSQC_Night mbyxaac2 - + - - - + + Ref DP-AC-302-CH-NOESY Group Butterworth_S
41 11:44:15 20250912-1246-B500_B.14-41 13 H1_COSY_HiRes_Night mbyxaac2 - + - - - + + Ref DP-AC-302-CH-NOESY Group Butterworth_S
41 11:15:41 20250912-1246-B500_B.14-41 12 C13_DEPT135_Night mbyxaac2 - + - - - + + Ref DP-AC-302-CH-NOESY Group Butterworth_S
41 11:01:17 20250912-1246-B500_B.14-41 11 C13_CPD_Night256 mbyxaac2 - + - - - + + Ref DP-AC-302-CH-NOESY Group Butterworth_S
41 10:55:33 20250912-1246-B500_B.14-41 10 H1_Night mbyxaac2 + + - + + + + Ref DP-AC-302-CH-NOESY Group Butterworth_S
40 10:32:20 20250912-1244-B500_B.14-40 13 H1_NOESY_Night mbyxaac2 - + - - - + + Ref DP-AC-CyBr Group Butterworth_S
40 10:25:40 20250912-1244-B500_B.14-40 12 H1_Night mbyxaac2 + + - + + + + Ref DP-AC-CyBr Group Butterworth_S
57 09:54:48 20250912-1120-B500_B.14-57 14 H1_C13_HMBC_US_Night y52364mw - + - - - + + Ref GDB-MJ-155-FULL Group DeBo_G
57 09:39:26 20250912-1120-B500_B.14-57 13 H1_C13_HSQC_US_Night y52364mw - + - - - + + Ref GDB-MJ-155-FULL Group DeBo_G
57 08:57:31 20250912-1120-B500_B.14-57 12 H1_COSY_HiRes_Night y52364mw - + - - - + + Ref GDB-MJ-155-FULL Group DeBo_G
57 08:03:32 20250912-1120-B500_B.14-57 11 C13_CPD_Night256 y52364mw - + - - - + + Ref GDB-MJ-155-FULL Group DeBo_G
57 07:57:18 20250912-1120-B500_B.14-57 10 H1_Night y52364mw + + - + + + + Ref GDB-MJ-155-FULL Group DeBo_G
25 05:51:19 20250912-0738-B500_B.14-25 12 H1_NOESY_US_Night m14269jw - + - - - + + Ref IR-JW-3098-RBINOL Group Riddell_I
25 05:10:51 20250912-0738-B500_B.14-25 11 H1_Night128 m14269jw + + - + + + + Ref IR-JW-3098-RBINOL Group Riddell_I
24 03:03:59 20250912-0738-B500_B.14-24 12 H1_NOESY_US_Night m14269jw - + - - - + + Ref IR-JW-3098-RPhEtOH Group Riddell_I
24 02:23:06 20250912-0738-B500_B.14-24 11 H1_Night128 m14269jw + + - + + + + Ref IR-JW-3098-RPhEtOH Group Riddell_I
23 00:16:39 20250912-0738-B500_B.14-23 12 H1_NOESY_US_Night m14269jw - + - - - + + Ref IR-JW-3098-LTrpOMe Group Riddell_I
23 23:35:59 20250912-0738-B500_B.14-23 11 H1_Night128 m14269jw + + - + + + + Ref IR-JW-3098-LTrpOMe Group Riddell_I
22 23:28:31 20250911-1726-B500_B.14-21 26 F19_NoCPD_Night h55599rb - + - - - + + Ref RB-silyl ether Group Procter_D
22 22:57:01 20250911-1726-B500_B.14-21 25 H1_C13_HMBC_Night h55599rb - + - - - + + Ref RB-silyl ether Group Procter_D
22 22:35:32 20250911-1726-B500_B.14-21 24 H1_C13_HSQC_Night h55599rb - + - - - + + Ref RB-silyl ether Group Procter_D
22 21:53:36 20250911-1726-B500_B.14-21 23 H1_COSY_HiRes_Night h55599rb - + - - - + + Ref RB-silyl ether Group Procter_D
22 21:26:12 20250911-1726-B500_B.14-21 22 C13_DEPT135_Night h55599rb - + - - - + + Ref RB-silyl ether Group Procter_D
22 21:11:48 20250911-1726-B500_B.14-21 21 C13_CPD_Night256 h55599rb - + - - - + + Ref RB-silyl ether Group Procter_D
22 21:06:32 20250911-1726-B500_B.14-21 20 H1_Night h55599rb + + - + + + + Ref RB-silyl ether Group Procter_D
21 20:35:00 20250911-1726-B500_B.14-21 15 H1_C13_HMBC_Night h55599rb - + - - - + + Ref RB-9-519 Group Procter_D
21 20:13:32 20250911-1726-B500_B.14-21 14 H1_C13_HSQC_Night h55599rb - + - - - + + Ref RB-9-519 Group Procter_D
21 19:31:38 20250911-1726-B500_B.14-21 13 H1_COSY_HiRes_Night h55599rb - + - - - + + Ref RB-9-519 Group Procter_D
21 19:17:13 20250911-1726-B500_B.14-21 11 C13_CPD_Night256 h55599rb - + - - - + + Ref RB-9-519 Group Procter_D
21 19:11:30 20250911-1726-B500_B.14-21 10 H1_Night h55599rb + + - + + + + Ref RB-9-519 Group Procter_D
10 18:00:22 20250911-1614-B500_B.14-10 10 H1_1024_Night y37570lc + + - + + + + Ref lc1011-1 Group DeBo_G
20 17:01:14 20250912-1623-B500_B.14-17 40 H1_Day z65435tw + + - + + + + Ref tw-1158-c-1h-cdcl3 Group Crisenza_G
19 16:55:20 20250912-1623-B500_B.14-17 30 H1_Day z65435tw + + - + + + + Ref tw-1157-c-1h-cdcl3 Group Crisenza_G
18 16:49:24 20250912-1623-B500_B.14-17 20 H1_Day z65435tw + + - + + + + Ref tw-1156-c-1h-cdcl3 Group Crisenza_G
17 16:43:32 20250912-1623-B500_B.14-17 10 H1_Day z65435tw + + - + + + + Ref tw-1155-c-1h-cdcl3 Group Crisenza_G
16 16:38:26 20250912-1554-B500_B.14-15 20 H1_Day m64645hs + + - + + + + Ref IR-HS-043 Group Natrajan_L
15 16:32:21 20250912-1554-B500_B.14-15 10 H1_Day m64645hs + + - + + + + Ref IR-HS-042 Group Natrajan_L
14 16:26:27 20250912-1619-B500_B.14-14 10 H1_Day a15978el + + - + + + + Ref EL-04-026-f28-40 Group James_M
13 16:21:02 20250912-1608-B500_B.14-11 30 H1_Day b26045ab + + - + + + + Ref AT-ABO-02-473-iso Group Trowbridge_A
12 16:15:33 20250912-1608-B500_B.14-11 20 H1_Day b26045ab + + - + + + + Ref AT-ABO-02-471-iso Group Trowbridge_A
11 16:10:03 20250912-1608-B500_B.14-11 10 H1_Day b26045ab + + - + + + + Ref AT-ABO-02-468-P Group Trowbridge_A
9 16:04:18 20250912-1533-B500_B.14-9 10 H1_Day x73847lm + + - + + + + Ref IR-LJM-01-116 F19 Group Riddell_I
8 15:57:48 20250912-1532-B500_B.14-8 10 H1_Day x73847lm + + - + + + + Ref IR-LJM-01-116 F16 Group Riddell_I
6 15:51:02 20250912-1510-B500_B.14-6 10 H1_Day j31752jy + + - + + + + Ref JY-IM-HEA53 Group Gibson_M
5 15:49:16 20250912-1508-B500_B.14-5 11 H1_ExtraWide_Day a17560mt - + - - - + + Ref REPW-MT088F1 Group Winpenny_R
5 15:41:29 20250912-1508-B500_B.14-5 10 H1_Wide_Day a17560mt + + - + + + + Ref REPW-MT088F1 Group Winpenny_R
4 15:35:55 20250912-1507-B500_B.14-4 11 H1_Day h18549ms - + - - - + + Ref JB_MS_02_032_SHAKE Group Bures_J
4 15:20:04 20250912-1507-B500_B.14-4 10 H1quant_Day h18549ms + + - + + + + Ref JB_MS_02_032_SHAKE Group Bures_J
3 15:13:55 20250912-1506-B500_B.14-3 10 H1_Day z88883sp + + - + + + + Ref SP370a Group Romanov_A After column
2 15:08:29 20250912-1420-B500_B.14-2 10 H1_Day z16689fe + + - + + + + Ref DJP FE 009 Group Procter_D Post-column, fraction two.
1 15:01:54 20250912-1420-B500_B.14-1 10 H1_Day z16689fe + + - + + + + Ref DJP FE 009 Group Procter_D Post-column, fraction one.
39 14:47:41 20250912-1442-B500_B.14-39 10 H1quant_Day g23544jd + + - + + + + Ref MJJ-JDL-05-061-x Group James_M
38 14:42:23 20250912-1426-B500_B.14-38 10 H1_Day y52364mw + + - + + + + Ref GDB-MJ-157-P2 Group DeBo_G
37 14:36:15 20250912-1426-B500_B.14-37 10 H1_Day y52364mw + + - + + + + Ref GDB-MJ-157-P1 Group DeBo_G
36 14:30:54 20250912-1419-B500_B.14-36 10 H1_Day x73847lm + + - + + + + Ref IR-LJM-01-116 F20 Group Riddell_I
35 14:25:44 20250912-1419-B500_B.14-35 10 H1_Day x73847lm + + - + + + + Ref IR-LJM-01-116 F15 Group Riddell_I
33 14:22:48 20250912-1409-B500_B.14-33 11 C13_CPD_Day j45159ks - + - - - + + Ref ks171 Group Keerthi_A
33 14:17:25 20250912-1409-B500_B.14-33 10 H1_Day j45159ks + + - + x + + Ref ks171 Group Keerthi_A
32 14:11:56 20250912-1328-B500_B.14-32 10 H1_Day z65435tw + + - + + + + Ref tw-1154-c-1h-cdcl3 Group Crisenza_G
30 14:06:12 20250912-1356-B500_B.14-29 20 H1_Day z40241jm + + - + + + + Ref DJP-JIM-7-067-run2b Group Procter_D
29 14:00:51 20250912-1356-B500_B.14-29 10 H1_Day z40241jm + + - + + + + Ref DJP-JIM-7-067-run2a Group Procter_D
28 13:55:24 20250912-1327-B500_B.14-26 30 H1_Day z65435tw + + - + + + + Ref tw-1153-c-1h-cdcl3 Group Crisenza_G
27 13:50:06 20250912-1327-B500_B.14-26 20 H1_Day z65435tw + + - + + + + Ref tw-1152-c-1h-cdcl3 Group Crisenza_G
26 13:44:23 20250912-1327-B500_B.14-26 10 H1_Day z65435tw + + - + + + + Ref tw-1151-c-1h-cdcl3 Group Crisenza_G
20 13:38:53 20250912-1325-B500_B.14-18 30 H1_Day z65435tw + + - + + + + Ref tw-1150-c-1h-cdcl3 Group Crisenza_G
19 13:33:25 20250912-1325-B500_B.14-18 20 H1_Day z65435tw + + - + + + + Ref tw-1149-c-1h-cdcl3 Group Crisenza_G
18 13:26:29 20250912-1325-B500_B.14-18 10 H1_Day z65435tw + + - + + + + Ref tw-1148-c-1h-cdcl3 Group Crisenza_G
15 13:14:22 20250912-1314-B500_B.14-15 10 H1_Day z16689fe + + - + + + + Ref TEST 12/09/25 Group Procter_D
1 12:51:52 20250912-1238-B500_B.14-1 10 H1_Day z16689fe + + - + + + + Ref DJP FE 009 (crude) Group Procter_D
40 12:46:33 20250912-1244-B500_B.14-40 10 H1_Day mbyxaac2 + + - + + + + Ref DP-AC-CyBr Group Butterworth_S
39 12:41:37 20250912-1216-B500_B.14-39 10 H1_Day a15978el + + - + + + + Ref EL-04-023-f22-38 Group James_M
38 12:36:41 20250912-1216-B500_B.14-38 10 H1_Day a15978el + + - + + + + Ref EL-04-023-f16-21 Group James_M
37 12:31:14 20250912-1215-B500_B.14-37 10 H1_Day a15978el + + - + + + + Ref EL-04-021-f11-17 Group James_M
34 12:15:00 20250910-1416-B500_B.14-34 24 H1quant_Day h18549ms + + - + + + + Ref JB_MS_02_032 Group Bures_J
59 11:57:03 20250912-1156-B500_B.14-59 10 H1_Day y38246dt + + - + + + + Ref GDB-DT-941-Cr Group DeBo_G GDB-DT-941-Cr
58 11:17:43 20250912-1117-B500_B.14-58 10 H1_Day b26045ab + + - + + + + Ref AT-ABO-02-470-iso Group Trowbridge_A
57 11:01:49 20250912-1101-B500_B.14-57 10 H1_Day y52364mw + + - + + + + Ref GDB-MJ-155-Full Group DeBo_G
54 10:22:40 20250912-1022-B500_B.14-54 10 H1_Day m14269jw + + - + + + + Ref IR-JW-3079-Dioxane Group Riddell_I
52 10:02:42 20250912-0949-B500_B.14-52 11 H1_ExtraWide_Day a17560mt - + - - - + + Ref REPW-MT102 Group Winpenny_R
52 09:56:51 20250912-0949-B500_B.14-52 10 H1_Wide_Day a17560mt + + - + + + + Ref REPW-MT102 Group Winpenny_R
51 09:55:08 20250911-1213-B500_B.14-51 12 H1_ExtraWide_Day a17560mt - + - - - + + Ref REPW-MT094b Group Winpenny_R
51 09:49:40 20250911-1213-B500_B.14-51 11 H1_Wide_Day a17560mt + + - + + + + Ref REPW-MT094b Group Winpenny_R
25 09:12:58 20250912-0738-B500_B.14-25 10 H1_Day m14269jw + + - + + + + Ref IR-JW-3098-RBINOL Group Riddell_I
24 09:07:36 20250912-0738-B500_B.14-24 10 H1_Day m14269jw + + - + + + + Ref IR-JW-3098-RPhEtOH Group Riddell_I
23 09:02:10 20250912-0738-B500_B.14-23 10 H1_Day m14269jw + + - + + + + Ref IR-JW-3098-LTrpOMe Group Riddell_I
21 08:31:02 20250911-1726-B500_B.14-21 12 C13_DEPT135_Night h55599rb + + - + + + + Ref RB-9-519 Group Procter_D
34 08:15:00 20250910-1416-B500_B.14-34 23 H1quant_Day h18549ms + + - + + + + Ref JB_MS_02_032 Group Bures_J
14 06:54:43 20250911-1612-B500_B.14-14 10 H1_1024_Night y37570lc + + - + + + + Ref lc626-1 MeOH E1193 CD3CN Group DeBo_G
13 05:42:58 20250911-1612-B500_B.14-13 10 H1_1024_Night y37570lc + + - + + + + Ref lc626-1 polymer E1193 CD3CN Group DeBo_G
12 04:31:05 20250911-1611-B500_B.14-12 10 H1_1024_Night y37570lc + + - + + + + Ref lc618-1 polymer E1192 CD3CN Group DeBo_G
34 04:15:00 20250910-1416-B500_B.14-34 22 H1quant_Day h18549ms + + - + + + + Ref JB_MS_02_032 Group Bures_J
11 02:55:39 20250911-1610-B500_B.14-11 10 H1_1024_Night y37570lc + + - + + + + Ref lc618-1 MeOH E1192 CD3CN Group DeBo_G
7 02:24:09 20250911-0859-B500_B.14-7 15 H1_C13_HMBC_Night g23544jd - + - - - + + Ref MJJ-JDL-05-058-P- Group James_M
7 02:02:38 20250911-0859-B500_B.14-7 14 H1_C13_HSQC_Night g23544jd - + - - - + + Ref MJJ-JDL-05-058-P- Group James_M
7 01:20:20 20250911-0859-B500_B.14-7 13 H1_COSY_HiRes_Night g23544jd - + - - - + + Ref MJJ-JDL-05-058-P- Group James_M
7 00:52:28 20250911-0859-B500_B.14-7 12 C13_DEPT135_Night g23544jd - + - - - + + Ref MJJ-JDL-05-058-P- Group James_M
7 00:38:02 20250911-0859-B500_B.14-7 11 C13_CPD_Night256 g23544jd - + - - - + + Ref MJJ-JDL-05-058-P- Group James_M
7 00:30:48 20250911-0859-B500_B.14-7 10 H1_Night g23544jd + + - + + + + Ref MJJ-JDL-05-058-P- Group James_M
34 00:15:00 20250910-1416-B500_B.14-34 21 H1quant_Day h18549ms + + - + + + + Ref JB_MS_02_032 Group Bures_J
43 22:12:07 20250911-1123-B500_B.14-43 11 H1_Night_1024 y38246dt + + - + + + + Ref GDB-DT-935-Cr Group DeBo_G GDB-DT-935-Cr
2 21:50:37 20250911-0811-B500_B.14-2 16 H1_C13_HSQC_Night z16689fe - + - - - + + Ref DJP FE 001 Group Procter_D target compound
2 21:19:04 20250911-0811-B500_B.14-2 15 H1_C13_HMBC_Night z16689fe - + - - - + + Ref DJP FE 001 Group Procter_D target compound
2 21:16:24 20250911-0811-B500_B.14-2 14 H1_Night z16689fe - + - - - + + Ref DJP FE 001 Group Procter_D target compound
2 20:48:59 20250911-0811-B500_B.14-2 13 C13_DEPT135_Night z16689fe - + - - - + + Ref DJP FE 001 Group Procter_D target compound
2 20:30:26 20250911-0811-B500_B.14-2 12 C13_CPD_Night256 z16689fe + + - + + + + Ref DJP FE 001 Group Procter_D target compound
34 20:15:00 20250910-1416-B500_B.14-34 20 H1quant_Day h18549ms + + - + + + + Ref JB_MS_02_032 Group Bures_J
33 18:59:33 20250910-1841-B500_B.14-33 11 H1_COSY_HiRes_Night z40973rs - + - - - + + Ref gdb-rs-127 crude (squaramide) Group DeBo_G
33 18:45:49 20250910-1841-B500_B.14-33 10 H1_Night128 z40973rs + + - + + + + Ref gdb-rs-127 crude (squaramide) Group DeBo_G
35 18:00:17 20250910-1842-B500_B.14-35 11 H1_COSY_HiRes_Night z40973rs + + - + + + + Ref gdb-rs-126 crude (HMAM) Group DeBo_G
26 17:40:21 20250911-1731-B500_B.14-26 10 H1_Day z86427mk + + - + + + + Ref MK-230 F34 Group Procter_D
25 17:33:25 20250911-1731-B500_B.14-25 10 H1_Day z86427mk + + - + + + + Ref MK-230 F18-33 Group Procter_D
23 17:27:41 20250911-1727-B500_B.14-23 10 H1_Day h55599rb + + - + + + + Ref RB-9-559 Group Procter_D
53 16:39:54 20250911-1632-B500_B.14-53 11 C13_CPD_Day c62220rg - + - - - + + Ref rg aldol Group Trowbridge_A
53 16:32:47 20250911-1632-B500_B.14-53 10 H1_Day c62220rg + + - + + + + Ref rg aldol Group Trowbridge_A
34 16:15:00 20250910-1416-B500_B.14-34 19 H1quant_Day h18549ms + + - + + + + Ref JB_MS_02_032 Group Bures_J
1 15:40:28 20250911-1540-B500_B.14-1 10 H1_Day z16689fe + + - + + + + Ref DJP FE 006 Group Procter_D post-column
45 15:21:55 20250911-1514-B500_B.14-45 10 H1_Day b26045ab + + - + + + + Ref AT-ABO-02-467-P1 Group Trowbridge_A
44 15:14:59 20250911-1501-B500_B.14-44 10 C13_CPD_Day z86427mk + + - + + + + Ref MK-226 Full Char Sample Group Procter_D
42 15:00:08 20250911-1448-B500_B.14-42 10 H1_Night128 m09677nb + + - + + + + Ref polyfunctional benzene Group Greaney_M
44 14:55:11 20250911-1452-B500_B.14-44 10 H1_Day y38246dt + + - + + + + Ref GDB-DT-940-Cr Group DeBo_G GDB-DT-940-Cr
42 14:49:49 20250911-1448-B500_B.14-42 11 F19_NoCPD_Day m09677nb + + - + + + + Ref polyfunctional benzene Group Greaney_M
41 14:31:26 20250911-1431-B500_B.14-41 10 H1_Day z40241jm + + - + + + + Ref DJP-JIM-7-084-1a Group Procter_D
39 14:21:04 20250911-1420-B500_B.14-39 10 H1_Day j82494jb + + - + + + + Ref QBB_E1_postWU Group Leigh_D
8 13:45:01 20250911-1344-B500_B.14-8 10 H1_Day z65435tw + + - + + + + Ref tw-1142-c-1h-cdcl3 Group Crisenza_G
5 13:33:55 20250911-1333-B500_B.14-5 10 H1_Day b26045ab + + - + + + + Ref AT-ABO-02-461-iso2 Group Trowbridge_A
4 12:56:54 20250911-1242-B500_B.14-4 11 C13_CPD_Day q85514th - + - - - + + Ref 201H-TBS Group Greaney_M
4 12:51:12 20250911-1242-B500_B.14-4 10 H1_Day q85514th + + - + + + + Ref 201H-TBS Group Greaney_M
3 12:48:13 20250911-1242-B500_B.14-3 11 C13_CPD_Day q85514th - + - - - + + Ref 5801H-TBS Group Greaney_M
3 12:43:22 20250911-1242-B500_B.14-3 10 H1_Day q85514th + + - + + + + Ref 5801H-TBS Group Greaney_M
1 12:36:35 20250911-1232-B500_B.14-1 10 H1_Day z16689fe + + - + + + + Ref DJP FE 006 (crude) Group Procter_D
43 12:30:19 20250911-1123-B500_B.14-43 10 H1_Day y38246dt + + - + + + + Ref GDB-DT-935-Cr Group DeBo_G GDB-DT-935-Cr
34 12:15:00 20250910-1416-B500_B.14-34 18 H1quant_Day h18549ms + + - + + + + Ref JB_MS_02_032 Group Bures_J
28 12:02:47 20250911-1202-B500_B.14-28 10 H1_Day b26045ab + + - + + + + Ref AT-ABO-02-469-cr Group Trowbridge_A
27 11:45:55 20250911-1141-B500_B.14-27 10 F19_NoCPD_Day a15978el + + - + + + + Ref EL-04-023-c Group James_M
26 11:41:01 20250911-1140-B500_B.14-26 10 F19_NoCPD_Day a15978el + + - + + + + Ref EL-04-022-c Group James_M
44 11:23:51 20250911-1123-B500_B.14-44 10 H1_Day y38246dt + + - + + + + Ref GDB-DT-938-Cr Group DeBo_G GDB-DT-938-Cr
40 10:43:07 20250911-1030-B500_B.14-40 10 H1_Day w52164bc + + - + + + + Ref BC-11-103 F32-36 Group James_M
38 10:24:35 20250911-0948-B500_B.14-38 11 C13_CPD_Night256 j40457bh + + - + + + + Ref bh ah 48 Group Trowbridge_A
1 10:18:23 20250911-1004-B500_B.14-1 10 H1_Day z16689fe + + - + + + + Ref DJP FE 003 Group Procter_D post-column
38 10:13:00 20250911-0948-B500_B.14-38 10 H1_Day j40457bh + + - + + + + Ref bh ah 48 Group Trowbridge_A
37 10:07:02 20250911-0947-B500_B.14-37 10 H1_Day z86427mk + + - + + + + Ref MK-231 Flush Group Procter_D
36 10:01:09 20250911-0947-B500_B.14-36 10 H1_Day z86427mk + + - + + + + Ref MK-231 F20-30 Group Procter_D
32 09:56:04 20250911-0946-B500_B.14-32 10 H1_Day z86427mk + + - + + + + Ref MK-231 F5-10 Group Procter_D
31 09:50:45 20250911-0946-B500_B.14-31 10 H1_Day z86427mk + + - + + + + Ref MK-231 F3-4 Group Procter_D
30 09:45:12 20250911-0942-B500_B.14-30 10 H1_Day c62220rg + + - + + + + Ref rg gta dev Group Trowbridge_A
28 09:40:17 20250911-0939-B500_B.14-28 10 H1_Day a15978el + + - + + + + Ref EL-04-024-c Group James_M
2 08:51:53 20250911-0811-B500_B.14-2 11 H1_COSY_Day z16689fe - + - - - + + Ref DJP FE 001 Group Procter_D target compound
2 08:45:05 20250911-0811-B500_B.14-2 10 H1_Day z16689fe + + - + + + + Ref DJP FE 001 Group Procter_D target compound
35 08:31:12 20250910-1842-B500_B.14-35 10 H1_Night128 z40973rs + + - + + + + Ref gdb-rs-126 crude (HMAM) Group DeBo_G
34 08:15:01 20250910-1416-B500_B.14-34 17 H1quant_Day h18549ms + + - + + + + Ref JB_MS_02_032 Group Bures_J
38 06:54:31 20250910-1538-B500_B.14-38 10 H1_1024_Night y37570lc + + - + + + + Ref lc626-1 post sonc E1193 Group DeBo_G
14 06:23:00 20250910-1321-B500_B.14-14 16 H1_C13_HMBC_Night y38246dt - + - - - + + Ref GDB-DT-937 Group DeBo_G GDB-DT-937
14 06:01:29 20250910-1321-B500_B.14-14 15 H1_C13_HSQC_Night y38246dt - + - - - + + Ref GDB-DT-937 Group DeBo_G GDB-DT-937
14 05:19:33 20250910-1321-B500_B.14-14 14 H1_COSY_HiRes_Night y38246dt - + - - - + + Ref GDB-DT-937 Group DeBo_G GDB-DT-937
14 04:52:09 20250910-1321-B500_B.14-14 13 C13_DEPT135_Night y38246dt - + - - - + + Ref GDB-DT-937 Group DeBo_G GDB-DT-937
14 04:37:44 20250910-1321-B500_B.14-14 12 C13_CPD_Night256 y38246dt - + - - - + + Ref GDB-DT-937 Group DeBo_G GDB-DT-937
14 04:31:10 20250910-1321-B500_B.14-14 11 H1_Night y38246dt + + - + + + + Ref GDB-DT-937 Group DeBo_G GDB-DT-937
34 04:15:00 20250910-1416-B500_B.14-34 16 H1quant_Day h18549ms + + - + + + + Ref JB_MS_02_032 Group Bures_J
37 02:53:24 20250910-1538-B500_B.14-37 10 H1_1024_Night y37570lc + + - + + + + Ref lc618-1 post sonc E1192 Group DeBo_G
49 02:22:00 20250910-1201-B500_B.14-49 15 H1_C13_HMBC_Night j40457bh - + - - - + + Ref bh ah 38 fc Group Trowbridge_A
49 02:00:31 20250910-1201-B500_B.14-49 14 H1_C13_HSQC_Night j40457bh - + - - - + + Ref bh ah 38 fc Group Trowbridge_A
49 01:18:36 20250910-1201-B500_B.14-49 13 H1_COSY_HiRes_Night j40457bh - + - - - + + Ref bh ah 38 fc Group Trowbridge_A
49 00:51:11 20250910-1201-B500_B.14-49 12 C13_DEPT135_Night j40457bh - + - - - + + Ref bh ah 38 fc Group Trowbridge_A
49 00:36:13 20250910-1201-B500_B.14-49 11 C13_CPD_Night256 j40457bh - + - - - + + Ref bh ah 38 fc Group Trowbridge_A
49 00:30:09 20250910-1201-B500_B.14-49 10 H1_Night j40457bh + + - + + + + Ref bh ah 38 fc Group Trowbridge_A
34 00:15:00 20250910-1416-B500_B.14-34 15 H1quant_Day h18549ms + + - + + + + Ref JB_MS_02_032 Group Bures_J
32 22:38:37 20250910-1404-B500_B.14-32 11 H1_Night_1024 y38246dt + + - + + + + Ref GDB-DT-936-Cr Group DeBo_G GDB-DT-936-Cr
19 22:36:50 20250910-0815-B500_B.14-19 16 F19_NoCPD_Day a15978el - + - - - + + Ref EL-04-013 full Group James_M
19 22:05:19 20250910-0815-B500_B.14-19 15 H1_C13_HMBC_Night a15978el - + - - - + + Ref EL-04-013 full Group James_M
19 21:43:49 20250910-0815-B500_B.14-19 14 H1_C13_HSQC_Night a15978el - + - - - + + Ref EL-04-013 full Group James_M
19 21:01:59 20250910-0815-B500_B.14-19 13 H1_COSY_HiRes_Night a15978el - + - - - + + Ref EL-04-013 full Group James_M
19 20:30:45 20250910-0815-B500_B.14-19 12 C13_DEPT135_Night a15978el + + - + + + + Ref EL-04-013 full Group James_M
34 20:15:00 20250910-1416-B500_B.14-34 14 H1quant_Day h18549ms + + - + + + + Ref JB_MS_02_032 Group Bures_J
47 20:05:40 20250910-1921-B500_B.14-44 40 H1_Day z65435tw + + - + + + + Ref tw-1147-c-1h-cdcl3 Group Crisenza_G
46 20:00:11 20250910-1921-B500_B.14-44 30 H1_Day z65435tw + + - + + + + Ref tw-1146-c-1h-cdcl3 Group Crisenza_G
45 19:54:44 20250910-1921-B500_B.14-44 20 H1_Day z65435tw + + - + + + + Ref tw-1145-c-1h-cdcl3 Group Crisenza_G
44 19:48:44 20250910-1921-B500_B.14-44 10 H1_Day z65435tw + + - + + + + Ref tw-1144-c-1h-cdcl3 Group Crisenza_G
31 18:30:37 20250910-1404-B500_B.14-31 11 H1_Night_1024 y38246dt + + - + + + + Ref GDB-DT-935-Cr Group DeBo_G GDB-DT-935-Cr
34 18:15:01 20250910-1416-B500_B.14-34 13 H1quant_Day h18549ms + + - + + + + Ref JB_MS_02_032 Group Bures_J
1 17:46:26 20250910-1729-B500_B.14-1 11 C13_CPD_Day v01423in + + - + + + + Ref Fr1 radmr Group Romanov_A Fr1 radmr
3 17:43:28 20250910-1729-B500_B.14-3 11 C13_CPD_Day v01423in - + - - - + + Ref Fr5 radmr Group Romanov_A Fr5 radmr
3 17:38:00 20250910-1729-B500_B.14-3 10 H1_Day v01423in + + - + + + + Ref Fr5 radmr Group Romanov_A Fr5 radmr
1 17:30:52 20250910-1729-B500_B.14-1 10 H1_Day v01423in + + - + + + + Ref Fr1 radmr Group Romanov_A Fr1 radmr
3 17:06:44 20250910-1658-B500_B.14-3 11 C13_CPD_Day q85514th - + - - - + + Ref 4001TPS-P Group Greaney_M
3 17:01:30 20250910-1658-B500_B.14-3 10 H1_Day q85514th + + - + + + + Ref 4001TPS-P Group Greaney_M
1 16:56:03 20250910-1650-B500_B.14-1 10 H1_Day z16689fe + + - + + + + Ref DJP FE 003 (crude) Group Procter_D
43 16:50:36 20250910-1645-B500_B.14-43 10 H1_Day a15978el + + - + + + + Ref EL-04-021-f13-14 w Group James_M
42 16:45:08 20250910-1623-B500_B.14-42 10 H1_Day j40457bh + + - + + + + Ref bh ah 45 c1 Group Trowbridge_A
41 16:39:13 20250910-1623-B500_B.14-41 10 H1_Day j40457bh + + - + + + + Ref bh ah 46 c1 s3 Group Trowbridge_A
36 16:33:47 20250910-1620-B500_B.14-36 10 H1_Day h91839em + + - + x + + Ref gc em 108 c Group Crisenza_G
34 16:17:36 20250910-1416-B500_B.14-34 12 H1quant_Day h18549ms + + - + + + + Ref JB_MS_02_032 Group Bures_J
22 16:11:20 20250910-1609-B500_B.14-22 10 H1_Day a15978el + + - + + + + Ref EL-04-021-f4-5 Group James_M
20 16:05:54 20250910-1605-B500_B.14-20 10 H1_Day x73847lm + + - + + + + Ref IR-LJM-01-117 R1 Group Riddell_I
36 15:46:50 20250910-1537-B500_B.14-36 10 H1_Day y37570lc + + - + + + + Ref lc1011-1 Group DeBo_G
35 15:40:46 20250910-1539-B500_B.14-35 10 H1_Day g16660ml + + - + + + + Ref djp-muze Group Procter_D
34 15:24:29 20250910-1416-B500_B.14-34 11 H1quant_Day h18549ms + + - + + + + Ref JB_MS_02_032 Group Bures_J
40 15:09:51 20250910-1506-B500_B.14-40 10 H1quant_Day g23544jd + + - + + + + Ref MJJ-JDL-5B-005-4 Group James_M
6 15:00:04 20250910-1459-B500_B.14-6 10 H1_Day z40973rs + + - + + + + Ref gdb-rs-125 1.0 eq of HMAM Group DeBo_G
2 14:47:03 20250910-1438-B500_B.14-2 10 H1_Day z16689fe + + - + + + + Ref DJP FE 001 Group Procter_D post-column, second fraction.
1 14:40:01 20250910-1438-B500_B.14-1 10 H1_Day z16689fe + + - + + + + Ref DJP FE 001 Group Procter_D post-column, first fraction.
35 14:33:03 20250910-1417-B500_B.14-35 10 H1_Day z40973rs + + - + + + + Ref gdb-rs-125 0.6 eq of HMAM Group DeBo_G
34 14:17:05 20250910-1416-B500_B.14-34 10 H1quant_Day h18549ms + + - + + + + Ref JB_MS_02_032 Group Bures_J
32 14:09:51 20250910-1404-B500_B.14-32 10 H1_Day y38246dt + + - + + + + Ref GDB-DT-936-Cr Group DeBo_G GDB-DT-936-Cr
31 14:04:56 20250910-1404-B500_B.14-31 10 H1_Day y38246dt + + - + + + + Ref GDB-DT-935-Cr Group DeBo_G GDB-DT-935-Cr
29 13:55:14 20250910-1353-B500_B.14-29 10 H1_Day m14269jw + + - + + + + Ref IR-JW-3096 Group Riddell_I
27 13:40:16 20250910-1339-B500_B.14-27 10 H1quant_Day h18549ms + + - + + + + Ref JB_MS_02_032_No_Oil Group Bures_J
25 13:29:57 20250910-1249-B500_B.14-25 10 H1_Day q49924rt + + - + + + + Ref RT_GelMA_Batch5 Group Cartmell_S
14 13:23:44 20250910-1321-B500_B.14-14 10 H1_Day y38246dt + + - + + + + Ref GDB-DT-937 Group DeBo_G GDB-DT-937
10 13:18:35 20250910-1314-B500_B.14-10 10 H1_Day z40241jm + + - + + + + Ref DJP-JIM-7-081-1b Group Procter_D
8 13:03:31 20250910-1302-B500_B.14-8 10 H1quant_Day g23544jd + + - + + + + Ref MJJ-JDL-05-054-3-c Group James_M
7 12:57:28 20250910-1252-B500_B.14-7 10 H1_Day y38246dt + + - + + + + Ref GDB-DT-937-Prep Group DeBo_G GDB-DT-937-Prep
6 12:50:23 20250910-1243-B500_B.14-6 10 H1_Day z40973rs + + - + + + + Ref gdb-rs-125 0.4 eq HMAM Group DeBo_G
5 12:45:10 20250910-1228-B500_B.14-5 10 H1_Day y52364mw + + - + + + + Ref GDB-MJ-L-valine Group DeBo_G
4 12:38:58 20250910-1227-B500_B.14-4 11 H1_COSY_Day y52364mw - + - - - + + Ref GDB-MJ-155-COSY-be washed Group DeBo_G
4 12:32:53 20250910-1227-B500_B.14-4 10 H1_Day y52364mw + + - + + + + Ref GDB-MJ-155-COSY-be washed Group DeBo_G
3 12:26:37 20250910-1220-B500_B.14-3 10 H1_Day z16689fe + + - + + + + Ref DJP FE 001 (crude) Group Procter_D
21 12:21:07 20250910-0831-B500_B.14-21 10 H1_Day z40973rs + + - + + + + Ref gdb-rs-125 0.2 eq of HMAM Group DeBo_G
20 12:15:38 20250910-1155-B500_B.14-17 30 H1_Day b26045ab + + - + + + + Ref AT-ABO-02-361-iso Group Trowbridge_A
18 12:10:31 20250910-1155-B500_B.14-17 20 H1_Day b26045ab + + - + + + + Ref AT-ABO-02-359-iso Group Trowbridge_A
17 12:04:25 20250910-1155-B500_B.14-17 10 H1_Day b26045ab + + - + + + + Ref AT-ABO-02-357-iso Group Trowbridge_A
16 12:01:30 20250910-1150-B500_B.14-16 11 C13_CPD_Day b36621hr - + - - - + + Ref DPM-HR199-C6D6 check Group Mills_D
16 11:55:44 20250910-1150-B500_B.14-16 10 H1_Day b36621hr + + - + + + + Ref DPM-HR199-C6D6 check Group Mills_D
13 11:41:12 20250910-1129-B500_B.14-13 11 C13_CPD_Night256 j40457bh - + - - - + + Ref bh ah 38 c1 fr6-8 Group Trowbridge_A
13 11:35:49 20250910-1129-B500_B.14-13 10 H1_Day j40457bh + + - + + + + Ref bh ah 38 c1 fr6-8 Group Trowbridge_A
12 11:29:41 20250910-1128-B500_B.14-12 10 H1_Day j40457bh + + - + + + + Ref bh ah 47 Group Trowbridge_A
11 11:27:59 20250910-1121-B500_B.14-11 11 F19_NoCPD_Day z88883sp - + - - - + + Ref SP369b Group Romanov_A SP369 MeOH washed
11 11:22:07 20250910-1121-B500_B.14-11 10 H1_Day z88883sp + + - + + + + Ref SP369b Group Romanov_A SP369 MeOH washed
9 11:15:42 20250910-1101-B500_B.14-9 11 C13_CPD_Day q85514th - + - - - + + Ref 501H-Ns 4Br Group Greaney_M
9 11:09:21 20250910-1101-B500_B.14-9 10 H1_Day q85514th + + - + + + + Ref 501H-Ns 4Br Group Greaney_M
8 11:03:17 20250910-1052-B500_B.14-8 10 H1_Day y52364mw + + - + + + + Ref GDB-MJ-155-be washed Group DeBo_G
7 10:58:17 20250910-1040-B500_B.14-7 10 H1_Day z88883sp + + - + + + + Ref SP368h Group Romanov_A Tail of band
6 10:52:50 20250910-1040-B500_B.14-6 10 H1_Day z88883sp + + - + + + + Ref SP368g Group Romanov_A Main body of band
5 10:49:51 20250910-1041-B500_B.14-5 11 C13_CPD_Day u67812sg - + - - - + + Ref sq-01-158 Group Procter_D
5 10:43:18 20250910-1041-B500_B.14-5 10 H1_Day u67812sg + + - + + + + Ref sq-01-158 Group Procter_D
4 10:37:13 20250910-1032-B500_B.14-4 10 H1_Day z40973rs + + - + + + + Ref gdb-rs-125-1 polymer only Group DeBo_G
3 10:31:55 20250910-1031-B500_B.14-3 10 H1_Day z16689fe + + - + + + + Ref DJP FE 002 Group Procter_D post-column
24 10:17:09 20250910-1011-B500_B.14-24 10 H1_Day g23544jd + + - + + + + Ref MJJ-JDL-05-058-Bot Group James_M
23 10:12:12 20250910-1011-B500_B.14-23 10 H1_Day g23544jd + + - + + + + Ref MJJ-JDL-05-058-P Group James_M
17 09:58:16 20250910-0954-B500_B.14-17 10 H1_Day j40457bh + + - + + + + Ref bh ah 45 Group Trowbridge_A
16 09:55:57 20250910-0949-B500_B.14-16 11 F19_NoCPD_Day c62220rg - + - - - + + Ref at-rg-4-9-r1 Group Trowbridge_A
16 09:49:36 20250910-0949-B500_B.14-16 10 H1_Day c62220rg + + - + + + + Ref at-rg-4-9-r1 Group Trowbridge_A
8 09:41:36 20250910-0941-B500_B.14-8 10 H1_Day m14269jw + + - + + + + Ref IR-JW-3095 Group Riddell_I
7 09:29:54 20250910-0923-B500_B.14-7 10 H1_Day a15978el + + - + + + + Ref EL-04-021-c Group James_M
6 09:24:36 20250910-0923-B500_B.14-6 10 H1_Day a15978el + + - + + + + Ref EL-04-020-c Group James_M
3 09:07:30 20250910-0857-B500_B.14-3 11 C13_CPD_Night256 z16689fe - + - - - + + Ref JDP FE SM2 Group Procter_D First batch of phenylacetylene.
3 09:01:39 20250910-0857-B500_B.14-3 10 H1_Day z16689fe + + - + + + + Ref JDP FE SM2 Group Procter_D First batch of phenylacetylene.
22 08:55:33 20250910-0855-B500_B.14-22 10 H1_Day b26045ab + + - + + + + Ref AT-ABO-02-464-cr Group Trowbridge_A
21 08:53:33 20250910-0831-B500_B.14-21 11 F19_NoCPD_Day u50028ip - + - - - + + Ref NP-1797 no heat Group Larrosa_I
21 08:47:21 20250910-0831-B500_B.14-21 10 H1_Day u50028ip + + - + + + + Ref NP-1797 no heat Group Larrosa_I
19 08:32:57 20250910-0815-B500_B.14-19 11 C13_CPD_Night256 a15978el - + - - - + + Ref EL-04-013 full Group James_M
19 08:26:54 20250910-0815-B500_B.14-19 10 H1_Night a15978el + + - + + + + Ref EL-04-013 full Group James_M
17 08:12:16 20250910-0803-B500_B.14-17 10 H1quant_Day g23544jd + + - + + + + Ref MJJ-JDL-5B-005-3 Group James_M
15 08:08:37 20250910-0802-B500_B.14-15 11 C13_CPD_Day z40241jm - + - - - + + Ref DJP-JIM-7-078-1a-Upanshu Group Procter_D
15 08:02:36 20250910-0802-B500_B.14-15 10 H1_Day z40241jm + + - + + + + Ref DJP-JIM-7-078-1a-Upanshu Group Procter_D
13 22:20:16 20250909-2137-B500_B.14-9 50 H1_WaterSupp_Day x26213ll + + - + + + + Ref 250909-1.6v Group Schroder_M
12 22:12:06 20250909-2137-B500_B.14-9 40 H1_WaterSupp_Day x26213ll + + - + + + + Ref 250909-1.5v Group Schroder_M
11 22:03:38 20250909-2137-B500_B.14-9 30 H1_WaterSupp_Day x26213ll + + - + + + + Ref 250909-1.4v Group Schroder_M
10 21:54:05 20250909-2137-B500_B.14-9 20 H1_WaterSupp_Day x26213ll + + - + + + + Ref 250909-1.3v Group Schroder_M
14 21:48:18 20250909-2142-B500_B.14-14 10 H1_Day r25963ar + + - + + + + Ref N2I2 Ibrahim dried Group Romanov_A N2I2 Ibrahim dried
9 21:38:04 20250909-2137-B500_B.14-9 10 H1_WaterSupp_Day x26213ll + + - + + + + Ref 250909-1.2v Group Schroder_M
6 20:39:42 20250909-2022-B500_B.14-6 10 H1_Day r25963ar + + - + + + + Ref N2Br2 Ibrahim Group Romanov_A N2Br2 Ibrahim
5 20:34:39 20250909-2006-B500_B.14-5 10 H1_Day r25963ar + + - + + + + Ref N2l2 Ibrahim Group Romanov_A N2l2 Ibrahim
4 20:28:55 20250909-1923-B500_B.14-4 10 H1_Day r25963ar + + - + + + + Ref N2Cl2 Ibrahim Group Romanov_A N2Cl2 Ibrahim
2 19:57:26 20250909-1751-B500_B.14-2 15 H1_C13_HMBC_Night zzradcliffej - + - - - + + Ref 431-91 rt 4.0 min Group External
2 19:35:57 20250909-1751-B500_B.14-2 14 H1_C13_HSQC_Night zzradcliffej - + - - - + + Ref 431-91 rt 4.0 min Group External
2 18:54:07 20250909-1751-B500_B.14-2 13 H1_COSY_HiRes_Night zzradcliffej - + - - - + + Ref 431-91 rt 4.0 min Group External
2 18:26:43 20250909-1751-B500_B.14-2 12 C13_DEPT135_Night zzradcliffej - + - - - + + Ref 431-91 rt 4.0 min Group External
2 18:12:02 20250909-1751-B500_B.14-2 11 C13_CPD_Night256 zzradcliffej - + - - - + + Ref 431-91 rt 4.0 min Group External
2 18:06:23 20250909-1751-B500_B.14-2 10 H1_Night zzradcliffej + + - + + + + Ref 431-91 rt 4.0 min Group External
9 18:00:24 20250909-1741-B500_B.14-9 10 H1_Day z40241jm + + - + + + + Ref DJP-JIM-7-067-0-6.8mmol Group Procter_D
1 17:53:50 20250909-1748-B500_B.14-1 10 H1_Day z16689fe + + - + + + + Ref DJP FE 002 (crude) Group Procter_D
8 17:47:37 20250909-1637-B500_B.14-8 12 H1_COSY_Day z40973rs - + - - - + + Ref gdb-rs-anslyn cage Group DeBo_G
8 17:41:42 20250909-1637-B500_B.14-8 11 H1_Day z40973rs + + - + + + + Ref gdb-rs-anslyn cage Group DeBo_G