IconNMR Automation Run Status:
Day Experiments:	00:03
Busy Until:	Mon 12:52
Night Experiments:	13:04

Setup List

Holder	Status	Name	ExpNo	Experiment	User	Time	Title
3	Completed	20250622-1451-B500_B.14-3	10	N H1_Day Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 min 17 sec	z40241jm	00:01:17	Ref DJP-JIM-6-002-1-2a-postcol Group Procter_D
4	Completed	20250622-1531-B500_B.14-4	10	N H1_Day Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 min 17 sec	q85514th	00:01:17	Ref 303DI-Ns F1-2 Group Greaney_M
5	Completed	20250622-1531-B500_B.14-5	10	N H1_Day Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 min 17 sec	q85514th	00:01:17	Ref 303DI-Ns F3-4 Group Greaney_M
5	Completed	20250622-1531-B500_B.14-5	11	N F19_NoCPD_Day Fluorine, ns = 16, sw = 190 ppm, centre (o1p) = -100 ppm, time = 50 sec	q85514th	00:00:28	Ref 303DI-Ns F3-4 Group Greaney_M
5	Completed	20250622-1531-B500_B.14-5	12	N C13_CPD_Day Carbon, proton decoupled, ns = 64, sw = 255 ppm, centre (o1p) = 115 ppm, time = 3 min 29 sec	q85514th	00:01:51	Ref 303DI-Ns F3-4 Group Greaney_M
6	Submitted	20250623-1124-B500_B.14-6	10	n H1_Night Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 min 17 sec	m52750pm	00:01:17	Ref GCPM66Pchar Group Crisenza_G
6	Submitted	20250623-1124-B500_B.14-6	11	n C13_CPD_Night256 Carbon, proton decoupled, ns = 256, sw = 255 ppm, centre (o1p) = 115 ppm, time = 13 min 22 sec	m52750pm	00:13:22	Ref GCPM66Pchar Group Crisenza_G
6	Submitted	20250623-1124-B500_B.14-6	12	n C13_DEPT135_Night DEPT135, proton decoupled, ns = 512, sw = 255 ppm, centre (o1p) = 115 ppm, time = 26 min 23 sec	m52750pm	00:26:23	Ref GCPM66Pchar Group Crisenza_G
6	Submitted	20250623-1124-B500_B.14-6	13	c H1_COSY_HiRes_Night COSY, ns = 2, sw = auto, centre (o1p) = auto, time = 37 min 10 sec	m52750pm	00:40:20	Ref GCPM66Pchar Group Crisenza_G
6	Submitted	20250623-1124-B500_B.14-6	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	m52750pm	00:19:46	Ref GCPM66Pchar Group Crisenza_G
6	Submitted	20250623-1124-B500_B.14-6	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	m52750pm	00:29:35	Ref GCPM66Pchar Group Crisenza_G
7	Completed	20250622-1531-B500_B.14-7	10	N H1_Day Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 min 17 sec	q85514th	00:01:17	Ref 503DI-Ns F3-5 Group Greaney_M
7	Completed	20250622-1531-B500_B.14-7	11	N C13_CPD_Day Carbon, proton decoupled, ns = 64, sw = 255 ppm, centre (o1p) = 115 ppm, time = 3 min 29 sec	q85514th	00:01:51	Ref 503DI-Ns F3-5 Group Greaney_M
8	Completed	20250623-1035-B500_B.14-8	10	N H1_Day Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 min 17 sec	z40241jm	00:01:17	Ref DJP-JIM-7-006-2a-fraction1 Group Procter_D
8	Completed	20250623-1035-B500_B.14-8	11	N C13_CPD_Day Carbon, proton decoupled, ns = 64, sw = 255 ppm, centre (o1p) = 115 ppm, time = 3 min 29 sec	z40241jm	00:01:51	Ref DJP-JIM-7-006-2a-fraction1 Group Procter_D
9	Completed	20250623-1040-B500_B.14-9	10	N H1_WaterSupp_Day Proton with suppression of largest signal	f85241bm	00:02:24	Ref BM923-0 Group Bures_J Check no dmf from molsiebs
11	Completed	20250623-1053-B500_B.14-11	10	N H1_Day Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 min 17 sec	z86427mk	00:01:17	Ref MK-179 Group Procter_D
11	Submitted	20250623-1053-B500_B.14-11	11	n H1_Night Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 min 17 sec	z86427mk	00:01:17	Ref MK-179 Group Procter_D
11	Submitted	20250623-1053-B500_B.14-11	12	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-179 Group Procter_D
11	Submitted	20250623-1053-B500_B.14-11	13	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-179 Group Procter_D
11	Submitted	20250623-1053-B500_B.14-11	14	c H1_COSY_HiRes_Night COSY, ns = 2, sw = auto, centre (o1p) = auto, time = 37 min 10 sec	z86427mk	00:40:20	Ref MK-179 Group Procter_D
11	Submitted	20250623-1053-B500_B.14-11	15	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-179 Group Procter_D
11	Submitted	20250623-1053-B500_B.14-11	16	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-179 Group Procter_D
12	Completed	20250623-1053-B500_B.14-11	20	N H1_Day Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 min 17 sec	z86427mk	00:01:17	Ref MK-180 Group Procter_D
12	Submitted	20250623-1053-B500_B.14-11	21	n H1_Night Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 min 17 sec	z86427mk	00:01:17	Ref MK-180 Group Procter_D
12	Submitted	20250623-1053-B500_B.14-11	22	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-180 Group Procter_D
12	Submitted	20250623-1053-B500_B.14-11	23	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-180 Group Procter_D
12	Submitted	20250623-1053-B500_B.14-11	24	c H1_COSY_HiRes_Night COSY, ns = 2, sw = auto, centre (o1p) = auto, time = 37 min 10 sec	z86427mk	00:40:20	Ref MK-180 Group Procter_D
12	Submitted	20250623-1053-B500_B.14-11	25	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-180 Group Procter_D
12	Submitted	20250623-1053-B500_B.14-11	26	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-180 Group Procter_D
13	Completed	20250623-1055-B500_B.14-13	10	N H1_Day Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 min 17 sec	z86427mk	00:01:17	Ref MK-056 Group Procter_D
13	Submitted	20250623-1055-B500_B.14-13	11	n H1_Night Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 min 17 sec	z86427mk	00:01:17	Ref MK-056 Group Procter_D
13	Submitted	20250623-1055-B500_B.14-13	12	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-056 Group Procter_D
13	Submitted	20250623-1055-B500_B.14-13	13	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-056 Group Procter_D
13	Submitted	20250623-1055-B500_B.14-13	14	c H1_COSY_HiRes_Night COSY, ns = 2, sw = auto, centre (o1p) = auto, time = 37 min 10 sec	z86427mk	00:40:20	Ref MK-056 Group Procter_D
13	Submitted	20250623-1055-B500_B.14-13	15	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-056 Group Procter_D
13	Submitted	20250623-1055-B500_B.14-13	16	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-056 Group Procter_D
14	Completed	20250623-1103-B500_B.14-14	10	N H1_WaterSupp_Day Proton with suppression of largest signal	f85241bm	00:02:24	Ref BM923-01 Group Bures_J Check of fresh inhib-free DCM
15	Completed	20250623-1108-B500_B.14-15	10	N H1_Day Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 min 17 sec	j45159ks	00:01:17	Ref ks146-1 Group Keerthi_A
15	Completed	20250623-1108-B500_B.14-15	11	N C13_CPD_Day Carbon, proton decoupled, ns = 64, sw = 255 ppm, centre (o1p) = 115 ppm, time = 3 min 29 sec	j45159ks	00:01:51	Ref ks146-1 Group Keerthi_A
16	Completed	20250623-1056-B500_B.14-16	10	N H1_Day Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 min 17 sec	z86427mk	00:01:17	Ref MK-054-B Group Procter_D
16	Submitted	20250623-1056-B500_B.14-16	11	n H1_Night Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 min 17 sec	z86427mk	00:01:17	Ref MK-054-B Group Procter_D
16	Submitted	20250623-1056-B500_B.14-16	12	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-054-B Group Procter_D
16	Submitted	20250623-1056-B500_B.14-16	13	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-054-B Group Procter_D
16	Submitted	20250623-1056-B500_B.14-16	14	c H1_COSY_HiRes_Night COSY, ns = 2, sw = auto, centre (o1p) = auto, time = 37 min 10 sec	z86427mk	00:40:20	Ref MK-054-B Group Procter_D
16	Submitted	20250623-1056-B500_B.14-16	15	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-054-B Group Procter_D
16	Submitted	20250623-1056-B500_B.14-16	16	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-054-B Group Procter_D
17	Completed	20250623-1056-B500_B.14-17	10	N H1_Day Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 min 17 sec	z86427mk	00:01:17	Ref MK-054-C Group Procter_D
17	Submitted	20250623-1056-B500_B.14-17	11	n H1_Night Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 min 17 sec	z86427mk	00:01:17	Ref MK-054-C Group Procter_D
17	Submitted	20250623-1056-B500_B.14-17	12	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-054-C Group Procter_D
17	Submitted	20250623-1056-B500_B.14-17	13	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-054-C Group Procter_D
17	Submitted	20250623-1056-B500_B.14-17	14	c H1_COSY_HiRes_Night COSY, ns = 2, sw = auto, centre (o1p) = auto, time = 37 min 10 sec	z86427mk	00:40:20	Ref MK-054-C Group Procter_D
17	Submitted	20250623-1056-B500_B.14-17	15	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-054-C Group Procter_D
17	Submitted	20250623-1056-B500_B.14-17	16	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-054-C Group Procter_D
18	Completed	20250623-1108-B500_B.14-18	10	N H1_Day Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 min 17 sec	j45159ks	00:01:17	Ref ks146-2 Group Keerthi_A
18	Completed	20250623-1108-B500_B.14-18	11	N C13_CPD_Day Carbon, proton decoupled, ns = 64, sw = 255 ppm, centre (o1p) = 115 ppm, time = 3 min 29 sec	j45159ks	00:01:51	Ref ks146-2 Group Keerthi_A
19	Completed	20250623-1126-B500_B.14-19	10	N H1_Day Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 min 17 sec	m64645hs	00:01:17	Ref IR-HS-016_F_DMSO Group Natrajan_L
20	Completed	20250623-1126-B500_B.14-19	20	N H1_Day Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 min 17 sec	m64645hs	00:01:17	Ref IR-HS-016_O_CDCl3 Group Natrajan_L
21	Completed	20250623-1134-B500_B.14-21	10	N H1_Day Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 min 17 sec	p69174hv	00:01:17	Ref GC-HV RO10 P2 Group Crisenza_G
21	Completed	20250623-1134-B500_B.14-21	11	N C13_CPD_Day Carbon, proton decoupled, ns = 64, sw = 255 ppm, centre (o1p) = 115 ppm, time = 3 min 29 sec	p69174hv	00:01:51	Ref GC-HV RO10 P2 Group Crisenza_G
22	Completed	20250623-1154-B500_B.14-22	10	N H1_Day Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 min 17 sec	j34309ms	00:01:17	Ref ph-pdi-cdcl3 Group Mills_D
24	Completed	20250622-1432-B500_B.14-24	10	N F19_NoCPD_Day Fluorine, ns = 16, sw = 190 ppm, centre (o1p) = -100 ppm, time = 50 sec	b72547am	00:00:28	Ref 4-182 cr Group Larrosa_I
24	Completed	20250622-1432-B500_B.14-24	11	N H1_Day Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 min 17 sec	b72547am	00:01:17	Ref 4-182 cr Group Larrosa_I
25	Error	20250620-1039-B500_B.14-25	10	N H1_Day Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 min 17 sec	m75418lc	00:01:17	Ref LC LN 11 Group Natrajan_L
26	Completed	20250622-1919-B500_B.14-26	10	n H1_Night128 Proton, ns = 128, sw = 20 ppm, centre (o1p) = 6 ppm, time = 9 min 20 sec	e02956op	00:09:20	Ref GDB-OP0292-1H Group DeBo_G
26	Completed	20250622-1919-B500_B.14-26	11	n C13_CPD_Night256 Carbon, proton decoupled, ns = 256, sw = 255 ppm, centre (o1p) = 115 ppm, time = 13 min 22 sec	e02956op	00:52:51	Ref GDB-OP0292-13C Group DeBo_G
27	Completed	20250622-1920-B500_B.14-27	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-OP0293-1H Group DeBo_G
27	Completed	20250622-1920-B500_B.14-27	11	n C13_CPD_Night256 Carbon, proton decoupled, ns = 256, sw = 255 ppm, centre (o1p) = 115 ppm, time = 13 min 22 sec	e02956op	00:13:22	Ref GDB-OP0293-13C Group DeBo_G
31	Completed	20250623-0958-B500_B.14-31	10	N H1_Day Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 min 17 sec	z40241jm	00:01:17	Ref DJP-JIM-7-004-1a Group Procter_D
34	Completed	20250623-1007-B500_B.14-34	10	N H1_Day Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 min 17 sec	m61564jh	00:01:17	Ref JQ_21 Group Keerthi_A
38	Completed	20250623-0839-B500_B.14-38	10	N H1_Day Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 min 17 sec	mbdxkrn2	00:09:20	Ref GDB-RN KS0255 from Duwez group - Basic CDCl3 Group DeBo_G
39	Completed	20250623-1226-B500_B.14-39	10	N H1_Day Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 min 17 sec	y58410zl	00:01:17	Ref MMA-6/20/2025-0h Group MIG
40	Available	20250623-1229-B500_B.14-40	10	N H1_Day Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 min 17 sec	y58410zl	00:01:17	Ref MMA-6/20/2025-12min Group MIG
41	Submitted	20250623-1235-B500_B.14-41	10	N H1_Day Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 min 17 sec	q20548kk	00:01:17	Ref ak-kk-rm-1 Group Keerthi_A
42	Available	20250623-1225-B500_B.14-42	10		y58410zl		Group Other
43	Running	20250623-1230-B500_B.14-43	10	N H1_Day Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 min 17 sec	y58410zl	00:01:17	Ref MMA-6/20/2025-3h Group MIG
45	Submitted	20250623-1232-B500_B.14-45	10	N H1_Day Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 min 17 sec	y58410zl	00:01:17	Ref MMA-6/20/2025-12min Group MIG
46	Completed	20250623-0927-B500_B.14-46	10	N H1_Day Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 min 17 sec	u67812sg	00:01:17	Ref sq-01-116-1 Group Procter_D
46	Completed	20250623-0927-B500_B.14-46	11	N C13_CPD_Day Carbon, proton decoupled, ns = 64, sw = 255 ppm, centre (o1p) = 115 ppm, time = 3 min 29 sec	u67812sg	00:01:51	Ref sq-01-116-1 Group Procter_D
47	Completed	20250623-0927-B500_B.14-47	10	N H1_Day Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6 ppm, time = 1 min 17 sec	u67812sg	00:01:17	Ref sq-01-117-sm2 Group Procter_D
47	Completed	20250623-0927-B500_B.14-47	11	N C13_CPD_Day Carbon, proton decoupled, ns = 64, sw = 255 ppm, centre (o1p) = 115 ppm, time = 3 min 29 sec	u67812sg	00:01:51	Ref sq-01-117-sm2 Group Procter_D
57	Completed	20250622-1725-B500_B.14-57	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-134-P1 Group DeBo_G
58	Completed	20250622-1726-B500_B.14-58	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-134-P2 Group DeBo_G

History List

Holder	Time	Name	ExpNo	Experiment	User	Load	Atma	Spin	Lock	Shim	Acq	Proc	Title	Remarks
43	12:35:25	20250623-1230-B500_B.14-43	10	H1_Day	y58410zl	+	-	-	-	-	-	-	Ref MMA-6/20/2025-3h Group MIG
39	12:28:27	20250623-1226-B500_B.14-39	10	H1_Day	y58410zl	+	+	-	+	+	+	+	Ref MMA-6/20/2025-0h Group MIG
22	12:13:50	20250623-1154-B500_B.14-22	10	H1_Day	j34309ms	+	+	-	+	+	+	+	Ref ph-pdi-cdcl3 Group Mills_D
21	12:10:42	20250623-1134-B500_B.14-21	11	C13_CPD_Day	p69174hv	-	+	-	-	-	+	+	Ref GC-HV RO10 P2 Group Crisenza_G
21	12:04:35	20250623-1134-B500_B.14-21	10	H1_Day	p69174hv	+	+	-	+	+	+	+	Ref GC-HV RO10 P2 Group Crisenza_G
20	11:56:50	20250623-1126-B500_B.14-19	20	H1_Day	m64645hs	+	+	-	+	+	+	+	Ref IR-HS-016_O_CDCl3 Group Natrajan_L
19	11:51:16	20250623-1126-B500_B.14-19	10	H1_Day	m64645hs	+	+	-	+	+	+	+	Ref IR-HS-016_F_DMSO Group Natrajan_L
18	11:48:08	20250623-1108-B500_B.14-18	11	C13_CPD_Day	j45159ks	-	+	-	-	-	+	+	Ref ks146-2 Group Keerthi_A
18	11:41:25	20250623-1108-B500_B.14-18	10	H1_Day	j45159ks	+	+	-	+	+	+	+	Ref ks146-2 Group Keerthi_A
17	11:36:12	20250623-1056-B500_B.14-17	10	H1_Day	z86427mk	+	+	-	+	x	+	+	Ref MK-054-C Group Procter_D	Shim failed
16	11:30:37	20250623-1056-B500_B.14-16	10	H1_Day	z86427mk	+	+	-	+	+	+	+	Ref MK-054-B Group Procter_D
15	11:26:37	20250623-1108-B500_B.14-15	11	C13_CPD_Day	j45159ks	-	+	-	-	-	+	+	Ref ks146-1 Group Keerthi_A
15	11:20:50	20250623-1108-B500_B.14-15	10	H1_Day	j45159ks	+	+	-	+	+	+	+	Ref ks146-1 Group Keerthi_A
14	11:13:41	20250623-1103-B500_B.14-14	10	H1_WaterSupp_Day	f85241bm	+	+	-	+	+	+	+	Ref BM923-01 Group Bures_J Check of fresh inhib-free DCM
13	11:08:12	20250623-1055-B500_B.14-13	10	H1_Day	z86427mk	+	+	-	+	+	+	+	Ref MK-056 Group Procter_D
12	11:02:47	20250623-1053-B500_B.14-11	20	H1_Day	z86427mk	+	+	-	+	+	+	+	Ref MK-180 Group Procter_D
11	10:56:31	20250623-1053-B500_B.14-11	10	H1_Day	z86427mk	+	+	-	+	+	+	+	Ref MK-179 Group Procter_D
9	10:48:24	20250623-1040-B500_B.14-9	10	H1_WaterSupp_Day	f85241bm	+	+	-	+	+	+	+	Ref BM923-0 Group Bures_J Check no dmf from molsiebs
8	10:45:12	20250623-1035-B500_B.14-8	11	C13_CPD_Day	z40241jm	-	+	-	-	-	+	+	Ref DJP-JIM-7-006-2a-fraction1 Group Procter_D
8	10:39:39	20250623-1035-B500_B.14-8	10	H1_Day	z40241jm	+	+	-	+	+	+	+	Ref DJP-JIM-7-006-2a-fraction1 Group Procter_D
6	10:36:22	20250623-1028-B500_B.14-6	11	F19_NoCPD_Day	m52750pm	-	+	-	-	-	+	+	Ref GCPM66cru-F Group Crisenza_G
6	10:30:14	20250623-1028-B500_B.14-6	10	H1_Day	m52750pm	+	+	-	+	+	+	+	Ref GCPM66cru-H Group Crisenza_G
34	10:08:39	20250623-1007-B500_B.14-34	10	H1_Day	m61564jh	+	+	-	+	+	+	+	Ref JQ_21 Group Keerthi_A
31	09:58:47	20250623-0958-B500_B.14-31	10	H1_Day	z40241jm	+	+	-	+	+	+	+	Ref DJP-JIM-7-004-1a Group Procter_D
47	09:54:01	20250623-0927-B500_B.14-47	11	C13_CPD_Day	u67812sg	-	+	-	-	-	+	+	Ref sq-01-117-sm2 Group Procter_D
47	09:48:16	20250623-0927-B500_B.14-47	10	H1_Day	u67812sg	+	+	-	+	+	+	+	Ref sq-01-117-sm2 Group Procter_D
46	09:45:03	20250623-0927-B500_B.14-46	11	C13_CPD_Day	u67812sg	-	+	-	-	-	+	+	Ref sq-01-116-1 Group Procter_D
46	09:38:11	20250623-0927-B500_B.14-46	10	H1_Day	u67812sg	+	+	-	+	+	+	+	Ref sq-01-116-1 Group Procter_D
18	09:24:16	20250623-0923-B500_B.14-18	10	F19_NoCPD_Night	x73847lm	+	+	-	+	+	+	+	Ref IR-LJM-BF4 check Group Riddell_I
38	08:40:07	20250623-0839-B500_B.14-38	10	H1_Day	mbdxkrn2	+	+	-	+	+	+	+	Ref GDB-RN KS0255 from Duwez group - Basic CDCl3 Group DeBo_G
31	08:20:18	20250623-0820-B500_B.14-31	10	H1_Day	m14269jw	+	+	-	+	+	+	+	Ref IR-JW-3060-Batch3 Group Riddell_I
26	19:56:15	20250622-1919-B500_B.14-26	11	C13_CPD_Night256	e02956op	-	+	-	-	-	+	+	Ref GDB-OP0292-13C Group DeBo_G
26	19:41:07	20250622-1919-B500_B.14-26	10	H1_Night128	e02956op	+	+	-	+	+	+	+	Ref GDB-OP0292-1H Group DeBo_G
27	19:26:25	20250622-1920-B500_B.14-27	11	C13_CPD_Night256	e02956op	-	+	-	-	-	+	+	Ref GDB-OP0293-13C Group DeBo_G
27	19:20:32	20250622-1920-B500_B.14-27	10	H1_Day	e02956op	+	+	-	+	+	+	+	Ref GDB-OP0293-1H Group DeBo_G
58	17:32:38	20250622-1726-B500_B.14-58	10	H1_Day	y52364mw	+	+	-	+	+	+	+	Ref GDB-MJ-134-P2 Group DeBo_G
57	17:26:00	20250622-1725-B500_B.14-57	10	H1_Day	y52364mw	+	+	-	+	+	+	+	Ref GDB-MJ-134-P1 Group DeBo_G
7	16:03:27	20250622-1531-B500_B.14-7	11	C13_CPD_Day	q85514th	-	+	-	-	-	+	+	Ref 503DI-Ns F3-5 Group Greaney_M
7	15:57:11	20250622-1531-B500_B.14-7	10	H1_Day	q85514th	+	+	-	+	+	+	+	Ref 503DI-Ns F3-5 Group Greaney_M
6	15:49:56	20250622-1531-B500_B.14-6	10	H1_Day	q85514th	+	+	-	+	+	+	+	Ref 303DI-Ns F7-11 Group Greaney_M
5	15:45:40	20250622-1531-B500_B.14-5	12	C13_CPD_Day	q85514th	-	+	-	-	-	+	+	Ref 303DI-Ns F3-4 Group Greaney_M
5	15:43:30	20250622-1531-B500_B.14-5	11	F19_NoCPD_Day	q85514th	-	+	-	-	-	+	+	Ref 303DI-Ns F3-4 Group Greaney_M
5	15:37:24	20250622-1531-B500_B.14-5	10	H1_Day	q85514th	+	+	-	+	+	+	+	Ref 303DI-Ns F3-4 Group Greaney_M
4	15:31:45	20250622-1531-B500_B.14-4	10	H1_Day	q85514th	+	+	-	+	+	+	+	Ref 303DI-Ns F1-2 Group Greaney_M
3	14:52:16	20250622-1451-B500_B.14-3	10	H1_Day	z40241jm	+	+	-	+	+	+	+	Ref DJP-JIM-6-002-1-2a-postcol Group Procter_D
24	14:38:00	20250622-1432-B500_B.14-24	11	H1_Day	b72547am	-	+	-	-	-	+	+	Ref 4-182 cr Group Larrosa_I
24	14:32:43	20250622-1432-B500_B.14-24	10	F19_NoCPD_Day	b72547am	+	+	-	+	+	+	+	Ref 4-182 cr Group Larrosa_I
22	14:22:26	20250622-1421-B500_B.14-22	10	H1_Day	j31752jy	+	+	-	+	+	+	+	Ref JY-HEA40-3-t1 Group Gibson_M
21	12:20:07	20250622-1213-B500_B.14-20	20	H1_Day	z40241jm	+	+	-	+	+	+	+	Ref DJP-JIM-7-003-1b-byproduct Group Procter_D
20	12:14:37	20250622-1213-B500_B.14-20	10	H1_Day	z40241jm	+	+	-	+	+	+	+	Ref DJP-JIM-7-003-1a-product Group Procter_D
40	11:16:21	20250622-1115-B500_B.14-40	10	H1_Day	z40241jm	+	+	-	+	+	+	+	Ref DJP-JIM-7-002-1a-crude Group Procter_D
11	18:52:09	20250621-1255-B500_B.14-11	10	H1_1024_Night	y37570lc	+	+	-	+	+	+	+	Ref lc544-1 MeOH E1152-3 Group DeBo_G
10	17:41:03	20250621-1255-B500_B.14-10	10	H1_1024_Night	y37570lc	+	+	-	+	+	+	+	Ref lc544-1 polymer E1152-3 Group DeBo_G
9	16:29:44	20250621-1255-B500_B.14-9	10	H1_1024_Night	y37570lc	+	+	-	+	+	+	+	Ref lc544-1 MeOH E1152-2 Group DeBo_G
8	15:18:42	20250621-1255-B500_B.14-8	10	H1_1024_Night	y37570lc	+	+	-	+	+	+	+	Ref lc544-1 polymer E1152-2 Group DeBo_G
7	14:07:29	20250621-1254-B500_B.14-7	10	H1_1024_Night	y37570lc	+	+	-	+	+	+	+	Ref lc544-1 MeOH E1152-1 Group DeBo_G
6	12:54:45	20250621-1254-B500_B.14-6	10	H1_1024_Night	y37570lc	+	+	-	+	+	+	+	Ref c Group DeBo_G
3	12:18:52	20250621-1218-B500_B.14-3	10	H1_Day	j31752jy	+	+	-	+	+	+	+	Ref JY-HEA40-3-t0 Group Gibson_M
2	08:13:10	20250620-2048-B500_B.14-2	12	C13_DEPT135_Day	a74776dr	-	+	-	-	-	+	+	Ref DJP-DR-1-264-recrystallized Group Procter_D
2	07:58:32	20250620-2048-B500_B.14-2	11	C13_CPD_Night256	a74776dr	-	+	-	-	-	+	+	Ref DJP-DR-1-264-recrystallized Group Procter_D
2	07:49:54	20250620-2048-B500_B.14-2	10	H1_Night	a74776dr	+	+	-	+	+	+	+	Ref DJP-DR-1-264-recrystallized Group Procter_D
12	07:42:50	20250620-1803-B500_B.14-12	10	H1_Night	j31752jy	+	+	-	+	+	+	+	Ref JY-HEA40-2-t0-2 Group Gibson_M
5	07:11:09	20250620-1717-B500_B.14-5	15	H1_C13_HMBC_Night	h55599rb	-	+	-	-	-	+	+	Ref RB-9-540 Group Procter_D
5	06:49:29	20250620-1717-B500_B.14-5	14	H1_C13_HSQC_Night	h55599rb	-	+	-	-	-	+	+	Ref RB-9-540 Group Procter_D
5	06:07:26	20250620-1717-B500_B.14-5	13	H1_COSY_HiRes_Night	h55599rb	-	+	-	-	-	+	+	Ref RB-9-540 Group Procter_D
5	05:39:52	20250620-1717-B500_B.14-5	12	C13_DEPT135_Night	h55599rb	-	+	-	-	-	+	+	Ref RB-9-540 Group Procter_D
5	05:25:15	20250620-1717-B500_B.14-5	11	C13_CPD_Night256	h55599rb	-	+	-	-	-	+	+	Ref RB-9-540 Group Procter_D
5	05:18:51	20250620-1717-B500_B.14-5	10	H1_Night	h55599rb	+	+	-	+	+	+	+	Ref RB-9-540 Group Procter_D
40	04:07:43	20250620-1626-B500_B.14-40	10	H1_1024_Night	y37570lc	+	+	-	+	+	+	+	Ref lc544-1 post sonc E1152-3 Group DeBo_G
39	02:56:43	20250620-1626-B500_B.14-39	10	H1_1024_Night	y37570lc	+	+	-	+	+	+	+	Ref lc544-1 post sonc E1152-2 Group DeBo_G
38	01:44:24	20250620-1626-B500_B.14-38	10	H1_1024_Night	y37570lc	+	+	-	+	+	+	+	Ref lc544-1 post sonc E1152-1 Group DeBo_G
52	00:50:14	20250620-1454-B500_B.14-52	11	C13_CPD_Night256	m14269jw	-	+	-	-	-	+	+	Ref IR-LJM-01-100-1024Scans Group Riddell_I
52	23:30:04	20250620-1454-B500_B.14-52	10	H1_Night	m14269jw	+	+	-	+	+	+	+	Ref IR-LJM-01-100-1024Scans Group Riddell_I
59	22:58:25	20250620-1311-B500_B.14-59	15	H1_C13_HMBC_Night	m52750pm	-	+	-	-	-	+	+	Ref GCPM59F1Pchar Group Crisenza_G
59	22:36:44	20250620-1311-B500_B.14-59	14	H1_C13_HSQC_Night	m52750pm	-	+	-	-	-	+	+	Ref GCPM59F1Pchar Group Crisenza_G
59	21:54:43	20250620-1311-B500_B.14-59	13	H1_COSY_HiRes_Night	m52750pm	-	+	-	-	-	+	+	Ref GCPM59F1Pchar Group Crisenza_G
59	21:27:08	20250620-1311-B500_B.14-59	12	C13_DEPT135_Night	m52750pm	-	+	-	-	-	+	+	Ref GCPM59F1Pchar Group Crisenza_G
59	21:12:28	20250620-1311-B500_B.14-59	11	C13_CPD_Night256	m52750pm	-	+	-	-	-	+	+	Ref GCPM59F1Pchar Group Crisenza_G
59	21:04:54	20250620-1311-B500_B.14-59	10	H1_Night	m52750pm	+	+	-	+	+	+	+	Ref GCPM59F1Pchar Group Crisenza_G
1	20:33:15	20250620-1141-B500_B.14-1	15	H1_C13_HMBC_Night	e02956op	-	+	-	-	-	+	+	Ref GDB-OP0271-HMBC Group DeBo_G
1	20:11:26	20250620-1141-B500_B.14-1	14	H1_C13_HSQC_Night	e02956op	-	+	-	-	-	+	+	Ref GDB-OP0271-HSQC Group DeBo_G
1	19:29:15	20250620-1141-B500_B.14-1	13	H1_COSY_HiRes_Night	e02956op	-	+	-	-	-	+	+	Ref GDB-OP0271-COSY Group DeBo_G
1	19:01:26	20250620-1141-B500_B.14-1	12	C13_DEPT135_Night	e02956op	-	+	-	-	-	+	+	Ref GDB-OP0271-135DEPT Group DeBo_G
1	18:07:06	20250620-1141-B500_B.14-1	11	C13_CPD_Night256	e02956op	-	+	-	-	-	+	+	Ref GDB-OP0271-13C Group DeBo_G
1	18:00:21	20250620-1141-B500_B.14-1	10	H1_Night	e02956op	+	+	-	+	+	+	+	Ref GDB-OP0271-1H Group DeBo_G
15	17:37:55	20250620-1734-B500_B.14-15	10	H1_Day	w81612cw	+	+	-	+	+	+	+	Ref IL-CKW-PJ3-122 B re Group Mehta_M
24	17:23:03	20250620-1715-B500_B.14-24	11	C13_CPD_Night256	g23544jd	-	+	-	-	-	+	+	Ref MJJ-JDL-04-421-P(C) Group James_M
24	17:16:40	20250620-1715-B500_B.14-24	10	H1_Night	g23544jd	+	+	-	+	+	+	+	Ref MJJ-JDL-04-421-P(C) Group James_M
3	17:00:50	20250620-1659-B500_B.14-3	10	H1quant_Day	q80578pk	+	+	-	+	+	+	+	Ref MJJ-PK-01-006-D-ref-18.7mg Group Other
42	16:45:41	20250620-1615-B500_B.14-42	10	H1_Day	w81612cw	+	+	-	+	+	+	+	Ref IL-CKW-PJ3-122 A re Group Mehta_M
37	16:39:53	20250620-1624-B500_B.14-37	10	H1_Day	mbyxaac2	+	+	-	+	+	+	+	Ref DP-AC-400-CDCl3 Group Butterworth_S
36	16:32:17	20250620-1613-B500_B.14-36	10	H1_Day	m90460ad	+	+	-	+	+	+	+	Ref mfg-ad-393b Group Greaney_M
35	16:26:09	20250620-1613-B500_B.14-35	10	H1_Day	m90460ad	+	+	-	+	+	+	+	Ref mfg-ad-397m Group Greaney_M
34	16:15:24	20250620-1612-B500_B.14-34	10	H1_Day	m90460ad	+	+	-	+	+	+	+	Ref mfg-ad-397b Group Greaney_M
32	16:06:57	20250620-1605-B500_B.14-32	10	H1_Day	j31752jy	+	+	-	+	+	+	+	Ref JY-HEA40-2-t0 Group Gibson_M
31	15:30:05	20250620-1513-B500_B.14-31	12	C13_DEPT135_Day	a74776dr	-	+	-	-	-	+	+	Ref DJP-DR-1-265-1-cr Group Procter_D
31	15:26:51	20250620-1513-B500_B.14-31	11	C13_CPD_Day	a74776dr	-	+	-	-	-	+	+	Ref DJP-DR-1-265-1-cr Group Procter_D
31	15:18:43	20250620-1513-B500_B.14-31	10	H1_Day	a74776dr	+	+	-	+	+	+	+	Ref DJP-DR-1-265-1-cr Group Procter_D
30	15:09:04	20250620-1449-B500_B.14-30	10	H1_Day	q85514th	+	+	-	+	+	+	+	Ref 803DI-Ns F23-30 Group Greaney_M
29	15:01:20	20250620-1449-B500_B.14-29	10	H1_Day	q85514th	+	+	-	+	+	+	+	Ref 802DI-Ns Group Greaney_M
28	14:58:07	20250620-1445-B500_B.14-28	11	C13_CPD_Day	z40241jm	-	+	-	-	-	+	+	Ref DJP-JIM-6-132-2a Group Procter_D
28	14:52:10	20250620-1445-B500_B.14-28	10	H1_Day	z40241jm	+	+	-	+	+	+	+	Ref DJP-JIM-6-132-2a Group Procter_D
27	14:46:07	20250620-1426-B500_B.14-27	10	H1_Day	w81612cw	+	+	-	+	+	+	+	Ref IL-CKW-PJ3-122 B Group Mehta_M
26	14:40:16	20250620-1426-B500_B.14-26	10	H1_Day	w81612cw	+	+	-	+	x	+	+	Ref IL-CKW-PJ3-122 A Group Mehta_M	Shim failed
13	14:21:40	20250620-1309-B500_B.14-13	11	C13_CPD_Night256	m52750pm	+	+	-	+	+	+	+	Ref GCEJ-002P-C Group Crisenza_G
4	14:18:27	20250620-1404-B500_B.14-4	11	C13_CPD_Day	j45159ks	-	+	-	-	-	+	+	Ref ks146 Group Keerthi_A
4	14:12:51	20250620-1404-B500_B.14-4	10	H1_Day	j45159ks	+	+	-	+	+	+	+	Ref ks146 Group Keerthi_A
3	14:04:01	20250620-1235-B500_B.14-3	12	C13_CPD_Day	w43932ra	+	+	-	+	+	+	+	Ref RA_TCA_B Group Gardiner_J
13	13:57:43	20250620-1309-B500_B.14-13	10	H1_Day	m52750pm	+	+	-	+	+	+	+	Ref GCEJ-002P-H Group Crisenza_G
11	13:48:32	20250620-1328-B500_B.14-11	10	H1_Day	m90460ad	+	+	-	+	+	+	+	Ref mfg-ad-396c Group Greaney_M
10	13:42:40	20250620-1327-B500_B.14-10	10	H1_Day	m90460ad	+	+	-	+	+	+	+	Ref mfg-ad-396b Group Greaney_M
9	13:35:31	20250620-1327-B500_B.14-9	10	H1_Day	m90460ad	+	+	-	+	+	+	+	Ref mfg-ad-396a Group Greaney_M
8	13:29:19	20250620-1326-B500_B.14-8	10	H1_Day	m90460ad	+	+	-	+	+	+	+	Ref mfg-ad-284b Group Greaney_M
7	13:22:59	20250620-1252-B500_B.14-7	10	H1_Day	q85514th	+	+	-	+	+	+	+	Ref TH2001DI-Ns Group Greaney_M
6	13:17:08	20250620-1252-B500_B.14-6	10	H1_Day	q85514th	+	+	-	+	+	+	+	Ref TH2001DI Group Greaney_M
5	13:10:55	20250620-1251-B500_B.14-5	10	H1_Day	q85514th	+	+	-	+	+	+	+	Ref TH003DI Group Greaney_M
4	13:04:47	20250620-1236-B500_B.14-4	10	H1_Day	mbyxaac2	+	+	-	+	+	+	+	Ref DP-AC-399-SM Group Butterworth_S
3	12:58:31	20250620-1235-B500_B.14-3	11	H1_COSY_Day	w43932ra	-	+	-	-	-	+	+	Ref RA_TCA_B Group Gardiner_J
3	12:51:06	20250620-1235-B500_B.14-3	10	H1_Day	w43932ra	+	+	-	+	+	+	+	Ref RA_TCA_B Group Gardiner_J
2	12:47:52	20250620-1235-B500_B.14-2	12	C13_CPD_Day	w43932ra	-	+	-	-	-	+	+	Ref RA_TCA_T Group Gardiner_J
2	12:41:34	20250620-1235-B500_B.14-2	11	H1_COSY_Day	w43932ra	-	+	-	-	-	+	+	Ref RA_TCA_T Group Gardiner_J
2	12:35:55	20250620-1235-B500_B.14-2	10	H1_Day	w43932ra	+	+	-	+	+	+	+	Ref RA_TCA_T Group Gardiner_J
24	12:24:29	20250620-1222-B500_B.14-24	10	H1_Day	y38246dt	+	+	-	+	+	+	+	Ref GDB-DS-002 Group DeBo_G GDB-DS-002
22	12:11:27	20250620-1200-B500_B.14-22	10	H1_Day	j31752jy	+	+	-	+	+	+	+	Ref JY-HEA40-t1 Group Gibson_M
21	12:04:40	20250620-1159-B500_B.14-21	10	H1_Day	j31752jy	+	+	-	+	+	+	+	Ref JY-HEA40-t0 Group Gibson_M
20	11:58:44	20250620-1158-B500_B.14-20	10	H1_Day	z40241jm	+	+	-	+	+	+	+	Ref DJP-JIM-6-132-1a Group Procter_D
14	11:36:28	20250620-1136-B500_B.14-14	10	H1_Day	m10213pw	+	+	-	+	+	+	+	Ref JW-PY3.6 Group Webb_S
12	11:30:58	20250620-1123-B500_B.14-12	11	F19_NoCPD_Day	c46714th	-	+	-	-	-	+	+	Ref TH-549-005-mother liquour Group James_M
12	11:24:23	20250620-1123-B500_B.14-12	10	H1_Day	c46714th	+	+	-	+	+	+	+	Ref TH-549-005-mother liquour Group James_M
10	11:09:03	20250620-1052-B500_B.14-10	11	F19_NoCPD_Day	mbdxwen2	-	+	-	-	-	+	+	Ref LN-EN-27-IBM Group Natrajan_L
10	11:01:28	20250620-1052-B500_B.14-10	10	H1_Day	mbdxwen2	+	+	-	+	+	+	+	Ref LN-EN-27-IBM Group Natrajan_L
9	10:58:58	20250620-1052-B500_B.14-9	11	F19_NoCPD_Day	mbdxwen2	-	+	-	-	-	+	+	Ref LN-EN-28-PS Group Natrajan_L
9	10:52:42	20250620-1052-B500_B.14-9	10	H1_Day	mbdxwen2	+	+	-	+	+	+	+	Ref LN-EN-28-PS Group Natrajan_L
25	10:44:13	20250620-1039-B500_B.14-25	10	H1_Day	m75418lc	x	-	-	-	-	-	-	Ref LC LN 11 Group Natrajan_L	Sample Changer: Error: SKIP_SAMPLE :: Error: No sample in position 25
20	10:37:49	20250620-1020-B500_B.14-20	10	H1_Day	mbyxaac2	+	+	-	+	+	+	+	Ref DP-AC-399-Crude Group Butterworth_S
19	10:32:47	20250620-1019-B500_B.14-19	10	H1_Day	m14269jw	+	+	-	+	+	+	+	Ref IR-JW-2089-Wash Group Riddell_I
18	10:27:44	20250620-1019-B500_B.14-18	10	H1_Day	m14269jw	+	+	-	+	+	+	+	Ref IR-JW-3048-Mix Group Riddell_I
17	10:19:28	20250620-1018-B500_B.14-17	10	H1_Day	m14269jw	+	+	-	+	+	+	+	Ref IR-JW-3052-Mix Group Riddell_I
4	09:23:21	20250620-0922-B500_B.14-4	10	C13_CPD_Night256	p10556ha	+	+	-	+	+	+	+	Ref HHA76 f4 c13 Group Keerthi_A
2	07:56:24	20250619-1945-B500_B.14-2	10	H1_Night	m52750pm	+	+	-	+	+	+	+	Ref GCPM62cru Group Crisenza_G
60	07:50:28	20250619-1923-B500_B.14-60	10	H1_Night	m52750pm	+	+	-	+	+	+	+	Ref GCPM59F3 Group Crisenza_G
59	07:43:40	20250619-1923-B500_B.14-59	10	H1_Night	m52750pm	+	+	-	+	+	+	+	Ref GCPM59F1 Group Crisenza_G
4	07:29:05	20250619-1858-B500_B.14-4	15	C13_CPD_Night256	b32507dt	-	+	-	-	-	+	+	Ref dtg16 Group Webb_S
4	06:57:21	20250619-1858-B500_B.14-4	14	H1_C13_HMBC_Night	b32507dt	-	+	-	-	-	+	+	Ref dtg16 Group Webb_S
4	06:41:47	20250619-1858-B500_B.14-4	13	H1_C13_HSQC_US_Night	b32507dt	-	+	-	-	-	+	+	Ref dtg16 Group Webb_S
4	06:39:35	20250619-1858-B500_B.14-4	12	H1_Night	b32507dt	-	+	-	-	-	+	+	Ref dtg16 Group Webb_S
4	06:33:26	20250619-1858-B500_B.14-4	11	H1_COSY_Day	b32507dt	-	+	-	-	-	+	+	Ref dtg16 Group Webb_S
4	06:26:27	20250619-1858-B500_B.14-4	10	H1_Day	b32507dt	+	+	-	+	+	+	+	Ref dtg16 Group Webb_S
30	06:19:29	20250619-1807-B500_B.14-28	5	H1_Wide_Night	y59240mb	-	+	-	-	-	+	+	Ref 9.9 mg CTA in 700 microlit choroform Group McDonald_T 9.9 mg CTA in 700 microlit choroform
30	06:05:46	20250619-1807-B500_B.14-28	4	H1_Night128	y59240mb	+	+	-	+	+	+	+	Ref 9.9 mg CTA in 700 microlit choroform Group McDonald_T 9.9 mg CTA in 700 microlit choroform
29	05:58:50	20250619-1807-B500_B.14-28	4	H1_Wide_Night	y59240mb	-	+	-	-	-	+	+	Ref 10.3mg AIBN in 700 microlit choroform Group McDonald_T 10.3mg AIBN in 700 microlit choroform
29	05:44:41	20250619-1807-B500_B.14-28	3	H1_Night128	y59240mb	+	+	-	+	+	+	+	Ref 10.3mg AIBN in 700 microlit choroform Group McDonald_T 10.3mg AIBN in 700 microlit choroform
28	05:36:01	20250619-1807-B500_B.14-28	2	H1_Wide_Night	y59240mb	-	+	-	-	-	+	+	Ref 50 microlit (100.7 mg oegma in 700 microlit deuterium oxide) Group McDonald_T 50 microlit (100.7 mg oegma in 700 microlit deuterium oxide)
28	05:21:31	20250619-1807-B500_B.14-28	1	H1_Night128	y59240mb	+	+	-	+	+	+	+	Ref 50 microlit (100.7 mg oegma in 700 microlit deuterium oxide) Group McDonald_T 50 microlit (100.7 mg oegma in 700 microlit deuterium oxide)
56	05:00:38	20250619-1659-B500_B.14-56	11	C13_CPD_Night256	w30344xc	+	+	-	+	+	+	+	Ref xc10p Group Keerthi_A
20	04:15:40	20250619-1416-B500_B.14-20	18	H1_NOESY_US_Night	m14269jw	-	+	-	-	-	+	+	Ref IR-JW-3053-AnthraceneCageFC Group Riddell_I
20	03:43:57	20250619-1416-B500_B.14-20	17	H1_C13_HMBC_Night	m14269jw	-	+	-	-	-	+	+	Ref IR-JW-3053-AnthraceneCageFC Group Riddell_I
20	03:22:13	20250619-1416-B500_B.14-20	16	H1_C13_HSQC_Night	m14269jw	-	+	-	-	-	+	+	Ref IR-JW-3053-AnthraceneCageFC Group Riddell_I
20	02:40:12	20250619-1416-B500_B.14-20	15	H1_COSY_HiRes_Night	m14269jw	-	+	-	-	-	+	+	Ref IR-JW-3053-AnthraceneCageFC Group Riddell_I
20	02:12:30	20250619-1416-B500_B.14-20	14	C13_DEPT135_Night	m14269jw	-	+	-	-	-	+	+	Ref IR-JW-3053-AnthraceneCageFC Group Riddell_I
20	01:57:54	20250619-1416-B500_B.14-20	13	C13_CPD_Night256	m14269jw	-	+	-	-	-	+	+	Ref IR-JW-3053-AnthraceneCageFC Group Riddell_I
20	01:55:42	20250619-1416-B500_B.14-20	12	H1_Night	m14269jw	-	+	-	-	-	+	+	Ref IR-JW-3053-AnthraceneCageFC Group Riddell_I
20	01:41:08	20250619-1416-B500_B.14-20	11	H1_Night128	m14269jw	+	+	-	+	+	+	+	Ref IR-JW-3053-AnthraceneCageFC Group Riddell_I
40	01:26:31	20250619-1351-B500_B.14-40	11	C13_CPD_Night256	j45159ks	-	+	-	-	-	+	+	Ref ks145night Group Keerthi_A
40	01:11:45	20250619-1351-B500_B.14-40	10	H1_Night128	j45159ks	+	+	-	+	+	+	+	Ref ks145night Group Keerthi_A
58	00:40:08	20250619-1350-B500_B.14-58	15	H1_C13_HMBC_Night	m52750pm	-	+	-	-	-	+	+	Ref GCPM58PChar Group Crisenza_G
58	00:18:23	20250619-1350-B500_B.14-58	14	H1_C13_HSQC_Night	m52750pm	-	+	-	-	-	+	+	Ref GCPM58PChar Group Crisenza_G
58	23:36:23	20250619-1350-B500_B.14-58	13	H1_COSY_HiRes_Night	m52750pm	-	+	-	-	-	+	+	Ref GCPM58PChar Group Crisenza_G
58	23:08:46	20250619-1350-B500_B.14-58	12	C13_DEPT135_Night	m52750pm	-	+	-	-	-	+	+	Ref GCPM58PChar Group Crisenza_G
58	22:54:09	20250619-1350-B500_B.14-58	11	C13_CPD_Night256	m52750pm	-	+	-	-	-	+	+	Ref GCPM58PChar Group Crisenza_G
58	22:46:43	20250619-1350-B500_B.14-58	10	H1_Night	m52750pm	+	+	-	+	+	+	+	Ref GCPM58PChar Group Crisenza_G
3	22:12:24	20250619-1132-B500_B.14-3	16	H1_C13_HMBC_Night	e02956op	-	+	-	-	-	+	+	Ref GDB-OP0291-HMBC Group DeBo_G
3	21:39:00	20250619-1132-B500_B.14-3	15	H1_C13_HSQC_Night	e02956op	-	+	-	-	-	+	x	Ref GDB-OP0291-HSQC Group DeBo_G	Archive Data Set directory couldn't be created: /mnt/nasr/NMR/DeBo_G/data/e02956op/nmr NO ARCHIVING ATTEMPTED HERE, Archive Data Set directory couldn't be created: /mnt/nasr/NMR/DeBo_G/data/e02956op/nmr NO ARCHIVING ATTEMPTED HERE
3	20:45:36	20250619-1132-B500_B.14-3	14	H1_COSY_HiRes_Night	e02956op	-	+	-	-	-	+	x	Ref GDB-OP0291-COSY Group DeBo_G	Archive Data Set directory couldn't be created: /mnt/nasr/NMR/DeBo_G/data/e02956op/nmr NO ARCHIVING ATTEMPTED HERE, Archive Data Set directory couldn't be created: /mnt/nasr/NMR/DeBo_G/data/e02956op/nmr NO ARCHIVING ATTEMPTED HERE
3	20:05:31	20250619-1132-B500_B.14-3	13	C13_DEPT135_Night	e02956op	-	+	-	-	-	+	x	Ref GDB-OP0291-135DEPT Group DeBo_G	Archive Data Set directory couldn't be created: /mnt/nasr/NMR/DeBo_G/data/e02956op/nmr NO ARCHIVING ATTEMPTED HERE, Archive Data Set directory couldn't be created: /mnt/nasr/NMR/DeBo_G/data/e02956op/nmr NO ARCHIVING ATTEMPTED HERE
3	19:38:37	20250619-1132-B500_B.14-3	12	C13_CPD_Night256	e02956op	-	+	-	-	-	+	x	Ref GDB-OP0291-13C Group DeBo_G	Archive Data Set directory couldn't be created: /mnt/nasr/NMR/DeBo_G/data/e02956op/nmr NO ARCHIVING ATTEMPTED HERE, Archive Data Set directory couldn't be created: /mnt/nasr/NMR/DeBo_G/data/e02956op/nmr NO ARCHIVING ATTEMPTED HERE
3	18:10:28	20250619-1132-B500_B.14-3	11	H1_Night	e02956op	+	+	-	+	+	+	x	Ref GDB-OP0291-1H Group DeBo_G	Archive Data Set directory couldn't be created: /mnt/nasr/NMR/DeBo_G/data/e02956op/nmr NO ARCHIVING ATTEMPTED HERE, Archive Data Set directory couldn't be created: /mnt/nasr/NMR/DeBo_G/data/e02956op/nmr NO ARCHIVING ATTEMPTED HERE
9	17:51:58	20250619-1703-B500_B.14-9	10	C13_CPD_Night256	h91839em	+	+	-	+	+	+	+	Ref GC EM 44 Group Crisenza_G
4	17:45:40	20250619-1730-B500_B.14-4	10	H1_Day	m90460ad	+	+	-	+	+	+	+	Ref mfg-ad-393c Group Greaney_M
2	17:39:15	20250619-1730-B500_B.14-2	10	H1_Day	m90460ad	+	+	-	+	+	+	+	Ref mfg-ad-393b Group Greaney_M
1	17:32:44	20250619-1707-B500_B.14-1	10	H1_Day	p10556ha	+	+	-	+	+	+	+	Ref HA76f4 Group Keerthi_A
60	17:24:22	20250619-1706-B500_B.14-60	10	H1_Day	p10556ha	+	+	-	+	+	+	+	Ref HA76f3 Group Keerthi_A
59	17:18:15	20250619-1705-B500_B.14-59	10	H1_Day	p10556ha	+	+	-	+	+	+	+	Ref HA76f2 Group Keerthi_A
57	17:12:10	20250619-1705-B500_B.14-57	10	H1_Day	p10556ha	+	+	-	+	+	+	+	Ref HA76f1 Group Keerthi_A
56	17:06:46	20250619-1659-B500_B.14-56	10	H1_Day	w30344xc	+	+	-	+	+	+	+	Ref xc10p Group Keerthi_A
55	16:52:30	20250619-1652-B500_B.14-55	10	H1quant_Day	n38871ln	+	+	-	+	+	+	+	Ref ln88-1 Group Larrosa_I
1	16:43:16	20250619-1633-B500_B.14-1	12	F19_NoCPD_Day	m90460ad	-	+	-	-	-	+	+	Ref mfg-ad-393b Group Greaney_M
1	16:40:18	20250619-1633-B500_B.14-1	11	C13_CPD_Day	m90460ad	-	+	-	-	-	+	+	Ref mfg-ad-393b Group Greaney_M
1	16:34:54	20250619-1633-B500_B.14-1	10	H1_Day	m90460ad	+	+	-	+	x	+	+	Ref mfg-ad-393b Group Greaney_M	Shim failed
36	16:17:42	20250619-1616-B500_B.14-36	10	H1_Day	z88883sp	+	+	-	+	+	+	+	Ref XG12 Group Romanov_A Brown oil after silica plug
34	16:12:06	20250619-1547-B500_B.14-34	10	H1_Day	m75418lc	+	+	-	+	+	+	+	Ref LC LN 10 Group Natrajan_L
33	16:06:33	20250619-1546-B500_B.14-33	10	H1_Day	m75418lc	+	+	-	+	+	+	+	Ref LC LN 9 Group Natrajan_L
32	16:00:58	20250619-1537-B500_B.14-31	20	H1_Day	z40241jm	+	+	-	+	+	+	+	Ref DJP-JIM-6-13-2b Group Procter_D
31	15:55:19	20250619-1537-B500_B.14-31	10	H1_Day	z40241jm	+	+	-	+	+	+	+	Ref DJP-JIM-6-13-2a Group Procter_D
30	15:48:57	20250619-1528-B500_B.14-30	10	H1_Day	n06287cb	+	+	-	+	+	+	+	Ref IL-CB-761c Group Larrosa_I
29	15:41:44	20250619-1528-B500_B.14-29	10	H1_Day	n06287cb	+	+	-	+	+	+	+	Ref IL-CB-760c Group Larrosa_I
28	15:34:10	20250619-1528-B500_B.14-28	10	H1_Day	n06287cb	+	+	-	+	+	+	+	Ref IL-CB-759c Group Larrosa_I
27	15:28:05	20250619-1527-B500_B.14-27	10	H1_Day	n06287cb	+	+	-	+	x	+	+	Ref IL-CB-758c Group Larrosa_I	Shim failed
24	15:08:20	20250619-1455-B500_B.14-24	11	H1_COSY_Day	m10213pw	-	+	-	-	-	+	+	Ref SJW-PY1 Group Webb_S
24	15:02:52	20250619-1455-B500_B.14-24	10	H1_Day	m10213pw	+	+	-	+	+	+	+	Ref SJW-PY1 Group Webb_S
23	14:57:20	20250619-1457-B500_B.14-23	10	H1_Day	m14269jw	+	+	-	+	+	+	+	Ref IR-JW-3064 Group Riddell_I
22	14:52:03	20250619-1445-B500_B.14-22	10	H1_Day	mbyxaac2	+	+	-	+	+	+	+	Ref DP-AC-allylBr Group Butterworth_S
21	14:46:02	20250619-1435-B500_B.14-21	10	H1_Day	b32507dt	+	+	-	+	+	+	+	Ref dtcho dm Group Webb_S
20	14:39:46	20250619-1416-B500_B.14-20	10	H1_Day	m14269jw	+	+	-	+	+	+	+	Ref IR-JW-3053-AnthraceneCageFC Group Riddell_I
19	14:33:01	20250619-1414-B500_B.14-19	10	H1_Day	m90460ad	+	+	-	+	+	+	+	Ref mfg-ad-395b Group Greaney_M
18	14:26:08	20250619-1414-B500_B.14-18	10	H1_Day	m90460ad	+	+	-	+	+	+	+	Ref mfg-ad-395a Group Greaney_M
17	14:19:53	20250619-1413-B500_B.14-17	10	H1_Day	m90460ad	+	+	-	+	+	+	+	Ref mfg-ad-393 Group Greaney_M
16	14:05:24	20250619-1359-B500_B.14-16	11	C13_CPD_Night256	w30344xc	-	+	-	-	-	+	+	Ref xc08p Group Keerthi_A
16	14:00:11	20250619-1359-B500_B.14-16	10	H1_Day	w30344xc	+	+	-	+	+	+	+	Ref xc08p Group Keerthi_A
39	13:42:02	20250619-1341-B500_B.14-39	10	H1_Day	mbdxkrn2	+	+	-	+	+	+	+	Ref GDB-RN1487-6/7 Post-sonication polymer after hydrolysis then work-up - Acetone-d6 Group DeBo_G
5	12:25:25	20250619-1216-B500_B.14-5	10	H1_Day	h91839em	+	+	-	+	+	+	+	Ref GC EM 47C Group Crisenza_G
4	12:19:54	20250619-1215-B500_B.14-4	10	H1_Day	h91839em	+	+	-	+	+	+	+	Ref GC EM 46C Group Crisenza_G
2	12:05:54	20250619-1131-B500_B.14-2	11	H1_Night128	e02956op	+	+	-	+	+	+	+	Ref GDB-OP0289C-TRANS Group DeBo_G
8	12:00:25	20250619-1152-B500_B.14-8	10	H1_Day	h55599rb	+	+	-	+	+	+	+	Ref RB-9-542 Group Procter_D
7	11:54:43	20250619-1152-B500_B.14-7	10	H1_Day	h55599rb	+	+	-	+	+	+	+	Ref RB-9-541 Group Procter_D
5	11:48:41	20250619-1137-B500_B.14-5	10	H1_Day	m10213pw	+	+	-	+	+	+	+	Ref SJW-PY3.5 Group Webb_S
4	11:45:45	20250619-1135-B500_B.14-4	11	C13_CPD_Day	j45159ks	-	+	-	-	-	+	+	Ref ks145-ppt Group Keerthi_A
4	11:39:40	20250619-1135-B500_B.14-4	10	H1_Day	j45159ks	+	+	-	+	+	+	+	Ref ks145-ppt Group Keerthi_A
2	11:32:09	20250619-1131-B500_B.14-2	10	H1_Day	e02956op	+	+	-	+	+	+	+	Ref GDB-OP0289C-TRANS Group DeBo_G
6	10:57:41	20250619-1050-B500_B.14-6	10	H1_Day	x73847lm	+	+	-	+	+	+	+	Ref IR-LJM-089K.2 Group Riddell_I
4	10:50:04	20250619-1049-B500_B.14-4	10	C13_CPD_Day	x73847lm	+	+	-	+	+	+	+	Ref IR-LJM-01-097 new Group Riddell_I
1	10:45:05	20250619-1037-B500_B.14-1	11	F19_NoCPD_Day	b72547am	-	+	-	-	-	+	+	Ref 4-170 rack2 Group Larrosa_I
1	10:38:04	20250619-1037-B500_B.14-1	10	H1_Day	b72547am	+	+	-	+	+	+	+	Ref 4-170 rack2 Group Larrosa_I
33	10:28:33	20250619-1023-B500_B.14-33	10	H1_Day	m14269jw	+	+	-	+	+	+	+	Ref IR-JW-3060-Batch2 Group Riddell_I
32	10:23:37	20250619-1023-B500_B.14-32	10	H1_Day	m14269jw	+	+	-	+	+	+	+	Ref IR-JW-3060-MixedBatch Group Riddell_I
28	09:51:28	20250619-0951-B500_B.14-28	10	H1_Day	m14269jw	+	+	-	+	+	+	+	Ref IR-JW-3060-Batch2 Group Riddell_I
49	09:35:59	20250619-0919-B500_B.14-49	10	H1_Day	w52164bc	+	+	-	+	+	+	+	Ref BC-08-233 ArCl Group James_M
48	09:30:21	20250619-0919-B500_B.14-48	10	H1_Day	w52164bc	+	+	-	+	+	+	+	Ref BC-08-231 2.0 equiv. Group James_M
47	09:24:19	20250619-0918-B500_B.14-47	10	H1_Day	z40241jm	+	+	-	+	+	+	+	Ref DJP-JIM-6-131-1a Group Procter_D
45	09:22:12	20250619-0915-B500_B.14-45	11	F19_NoCPD_Day	w52164bc	-	+	-	-	-	+	+	Ref BC-08-224 Group James_M
45	09:15:16	20250619-0915-B500_B.14-45	10	H1_Day	w52164bc	+	+	-	+	+	+	+	Ref BC-08-224 Group James_M
56	05:58:30	20250618-1929-B500_B.14-56	10	H1_Night	m52750pm	+	+	-	+	+	+	+	Ref GCPM58Fresto Group Crisenza_G
60	05:52:47	20250618-1928-B500_B.14-60	10	H1_Night	m52750pm	+	+	-	+	+	+	+	Ref GCPM58F3 Group Crisenza_G
59	05:45:59	20250618-1928-B500_B.14-59	10	H1_Night	m52750pm	+	+	-	+	+	+	+	Ref GCPM58F2 Group Crisenza_G
58	05:40:18	20250618-1928-B500_B.14-58	10	H1_Night	m52750pm	+	+	-	+	+	+	+	Ref GCPM58F1 Group Crisenza_G
57	05:34:21	20250618-1926-B500_B.14-57	10	H1_Night	m52750pm	+	+	-	+	+	+	+	Ref GCPM57SM Group Crisenza_G
23	04:36:44	20250618-1426-B500_B.14-23	12	C13_CPD_Night256	h18549ms	+	+	-	+	+	+	+	Ref JB_MS_02_004_2 Group Bures_J
19	03:38:46	20250618-1425-B500_B.14-19	12	C13_CPD_Night256	h18549ms	+	+	-	+	+	+	+	Ref JB_MS_02_004_1 Group Bures_J
15	02:40:43	20250618-1421-B500_B.14-15	12	C13_CPD_Night256	h18549ms	+	+	-	+	+	+	+	Ref JB_MS_02_004_S Group Bures_J
33	01:46:47	20250618-1912-B500_B.14-33	12	C13_CPD_Night256	h18549ms	-	+	-	-	-	+	+	Ref JB_MS_02_004_6 Group Bures_J
33	01:34:40	20250618-1912-B500_B.14-33	11	H1_WaterSupp_Day	h18549ms	-	+	-	-	-	+	+	Ref JB_MS_02_004_6 Group Bures_J
33	01:18:54	20250618-1912-B500_B.14-33	10	H1quant_Day	h18549ms	+	+	-	+	+	+	+	Ref JB_MS_02_004_6 Group Bures_J
32	01:12:36	20250618-1808-B500_B.14-32	10	H1_Night	m90460ad	+	+	-	+	+	+	+	Ref mfg-ad-395 Group Greaney_M
31	00:18:36	20250618-1736-B500_B.14-31	12	C13_CPD_Night256	h18549ms	-	+	-	-	-	+	+	Ref JB_MS_02_004_5 Group Bures_J
31	00:08:50	20250618-1736-B500_B.14-31	11	H1_WaterSupp_Day	h18549ms	-	+	-	-	-	+	+	Ref JB_MS_02_004_5 Group Bures_J
31	23:53:00	20250618-1736-B500_B.14-31	10	H1quant_Day	h18549ms	+	+	-	+	+	+	+	Ref JB_MS_02_004_5 Group Bures_J
29	22:59:00	20250618-1735-B500_B.14-29	12	C13_CPD_Night256	h18549ms	-	+	-	-	-	+	+	Ref JB_MS_02_004_4 Group Bures_J
29	22:49:10	20250618-1735-B500_B.14-29	11	H1_WaterSupp_Day	h18549ms	-	+	-	-	-	+	+	Ref JB_MS_02_004_4 Group Bures_J
29	22:33:00	20250618-1735-B500_B.14-29	10	H1quant_Day	h18549ms	+	+	-	+	+	+	+	Ref JB_MS_02_004_4 Group Bures_J
28	21:38:59	20250618-1732-B500_B.14-28	12	C13_CPD_Night256	h18549ms	-	+	-	-	-	+	+	Ref JB_MS_02_004_3 Group Bures_J
28	21:28:06	20250618-1732-B500_B.14-28	11	H1_WaterSupp_Day	h18549ms	-	+	-	-	-	+	+	Ref JB_MS_02_004_3 Group Bures_J
28	21:11:24	20250618-1732-B500_B.14-28	10	H1quant_Day	h18549ms	+	+	-	+	+	+	+	Ref JB_MS_02_004_3 Group Bures_J
8	19:55:08	20250618-1702-B500_B.14-8	11	C13_Quant_CPD_Night	a38518yl	+	+	-	+	+	+	+	Ref yl-alhatome white sht Group Keerthi_A
27	18:37:17	20250618-1536-B500_B.14-27	12	C13_Quant_CPD_Night	a38518yl	+	+	-	+	+	+	+	Ref yl-alhatome-washed2 Group Keerthi_A
30	18:05:27	20250618-1300-B500_B.14-30	10	H1_Quant_D1_73s_Night	b30323mh	+	+	-	+	+	+	+	Ref MH-TC2R9-Q test 2 Group Fielding_L
13	17:50:38	20250618-1557-B500_B.14-13	10	H1quant_Day	q80578pk	+	+	-	+	+	+	+	Ref MJJ-PK-01-006-31305024 Group Other
12	17:34:26	20250618-1554-B500_B.14-12	10	H1quant_Day	q80578pk	+	+	-	+	+	+	+	Ref MJJ-PK-01-006-51305024L Group Other
8	17:19:19	20250618-1702-B500_B.14-8	10	H1quant_Day	a38518yl	+	+	-	+	+	+	+	Ref yl-alhatome white sht Group Keerthi_A
7	17:12:57	20250618-1700-B500_B.14-7	10	H1_Day	c62220rg	+	+	-	+	+	+	+	Ref ataw03 Group Trowbridge_A
6	17:09:57	20250618-1655-B500_B.14-6	11	C13_CPD_Day	j45159ks	-	+	-	-	-	+	+	Ref ks145_major Group Keerthi_A
6	17:04:20	20250618-1655-B500_B.14-6	10	H1_Day	j45159ks	+	+	-	+	+	+	+	Ref ks145_major Group Keerthi_A
5	16:58:49	20250618-1648-B500_B.14-5	10	H1_Day	m10213pw	+	+	-	+	+	+	+	Ref SJW-PY3.2 Group Webb_S
4	16:53:09	20250618-1647-B500_B.14-4	10	H1_Day	m10213pw	+	+	-	+	+	+	+	Ref SJW-PY3.1 Group Webb_S
3	16:47:32	20250618-1630-B500_B.14-3	10	H1_Day	y38246dt	+	+	-	+	+	+	+	Ref GDB-DS-001 Group DeBo_G GDB-DS-001
2	16:44:35	20250618-1513-B500_B.14-2	11	C13_CPD_Day	q49270na	-	+	-	-	-	+	+	Ref na-40 Group Greaney_M
2	16:38:50	20250618-1513-B500_B.14-2	10	H1_Day	q49270na	+	+	-	+	+	+	+	Ref na-40 Group Greaney_M
1	16:35:52	20250618-1512-B500_B.14-1	11	C13_CPD_Day	q49270na	-	+	-	-	-	+	+	Ref na-39 Group Greaney_M
1	16:29:22	20250618-1512-B500_B.14-1	10	H1_Day	q49270na	+	+	-	+	+	+	+	Ref na-39 Group Greaney_M
28	16:23:47	20250618-1558-B500_B.14-28	10	H1_Day	h68355ac	+	+	-	+	+	+	+	Ref MFG-AC-564-col Group Greaney_M
27	16:12:27	20250618-1536-B500_B.14-27	11	H1quant_Day	a38518yl	-	+	-	-	-	+	+	Ref yl-alhatome-washed2 Group Keerthi_A
27	16:03:29	20250618-1536-B500_B.14-27	10	H1_WaterSupp_Day	a38518yl	+	+	-	+	+	+	+	Ref yl-alhatome-washed2 Group Keerthi_A
26	15:57:25	20250618-1530-B500_B.14-26	10	H1_Day	h55599rb	+	+	-	+	+	+	+	Ref RB-9-529.4B Group Procter_D
25	15:51:16	20250618-1530-B500_B.14-25	10	H1_Day	h55599rb	+	+	-	+	+	+	+	Ref RB-9-529.4A Group Procter_D
23	15:39:14	20250618-1426-B500_B.14-23	11	H1_WaterSupp_Day	h18549ms	-	+	-	-	-	+	+	Ref JB_MS_02_004_2 Group Bures_J
23	15:23:16	20250618-1426-B500_B.14-23	10	H1quant_Day	h18549ms	+	+	-	+	+	+	+	Ref JB_MS_02_004_2 Group Bures_J
19	15:13:30	20250618-1425-B500_B.14-19	11	H1_WaterSupp_Day	h18549ms	-	+	-	-	-	+	+	Ref JB_MS_02_004_1 Group Bures_J
19	14:57:06	20250618-1425-B500_B.14-19	10	H1quant_Day	h18549ms	+	+	-	+	+	+	+	Ref JB_MS_02_004_1 Group Bures_J
17	14:51:05	20250618-1442-B500_B.14-17	10	H1_Day	w30344xc	+	+	-	+	+	+	+	Ref JQ_20 Group Keerthi_A
15	14:40:50	20250618-1421-B500_B.14-15	11	H1_WaterSupp_Day	h18549ms	-	+	-	-	-	+	+	Ref JB_MS_02_004_S Group Bures_J
15	14:24:51	20250618-1421-B500_B.14-15	10	H1quant_Day	h18549ms	+	+	-	+	+	+	+	Ref JB_MS_02_004_S Group Bures_J
13	14:19:17	20250618-1400-B500_B.14-13	10	H1_Day	w30344xc	-	+	-	-	-	+	+	Ref JQ_20 Group Keerthi_A
13	14:01:31	20250618-1400-B500_B.14-13	11	C13_CPD_Night256	w30344xc	+	+	-	+	+	+	+	Ref JQ_20 Group Keerthi_A
29	13:52:45	20250618-1346-B500_B.14-29	11	F19_NoCPD_Day	z88883sp	-	+	-	-	-	+	+	Ref XG09e Group Romanov_A Column 2, band 2
29	13:46:34	20250618-1346-B500_B.14-29	10	H1_Day	z88883sp	+	+	-	+	+	+	+	Ref XG09e Group Romanov_A Column 2, band 2
26	13:33:42	20250618-1333-B500_B.14-26	10	H1_Day	m14269jw	+	+	-	+	+	+	+	Ref IR-JW-3063-2nd ppt Group Riddell_I
59	13:03:03	20250618-1247-B500_B.14-59	10	H1_Day	m52750pm	+	+	-	+	+	+	+	Ref GCPM59cru Group Crisenza_G
58	12:55:54	20250618-1247-B500_B.14-58	10	H1_Day	m52750pm	+	+	-	+	+	+	+	Ref GCPM58cru Group Crisenza_G
2	12:49:55	20250618-1242-B500_B.14-2	10	H1_Day	m90460ad	+	+	-	+	+	+	+	Ref mfg-ad-394-1b Group Greaney_M
1	12:41:55	20250618-1241-B500_B.14-1	10	H1_Day	m14269jw	+	+	-	+	+	+	+	Ref IR-JW-3063-Crude Group Riddell_I
59	12:37:56	20250618-1222-B500_B.14-59	11	C13_CPD_Day	t13367jb	-	+	-	-	-	+	+	Ref mfg-jb-04-109-c Group Greaney_M mfg-jb-04-109-c
59	12:31:51	20250618-1222-B500_B.14-59	10	H1_Day	t13367jb	+	+	-	+	+	+	+	Ref mfg-jb-04-109-c Group Greaney_M mfg-jb-04-109-c
58	12:28:48	20250618-1221-B500_B.14-58	11	C13_CPD_Day	t13367jb	-	+	-	-	-	+	+	Ref mfg-jb-04-105-c-stronger Group Greaney_M mfg-jb-04-105-c-stronger
58	12:22:15	20250618-1221-B500_B.14-58	10	H1_Day	t13367jb	+	+	-	+	x	+	+	Ref mfg-jb-04-105-c-stronger Group Greaney_M mfg-jb-04-105-c-stronger	Shim failed
51	12:07:23	20250618-1205-B500_B.14-51	10	H1_Day	h91839em	+	+	-	+	+	+	+	Ref GC EM 45 C Group Crisenza_G
49	12:01:57	20250618-1144-B500_B.14-49	10	H1_Day	m52750pm	+	+	-	+	+	+	+	Ref GCPM52col4Fiv Group Crisenza_G
48	11:56:42	20250618-1144-B500_B.14-48	10	H1_Day	m52750pm	+	+	-	+	+	+	+	Ref GCPM52col4Fiii Group Crisenza_G
47	11:51:06	20250618-1144-B500_B.14-47	10	H1_Day	m52750pm	+	+	-	+	+	+	+	Ref GCPM52col4Fii Group Crisenza_G
46	11:45:26	20250618-1144-B500_B.14-46	10	H1_Day	m52750pm	+	+	-	+	+	+	+	Ref GCPM52col4FiPur Group Crisenza_G
36	11:34:56	20250618-1134-B500_B.14-36	10	H1_Day	mbyxaac2	+	+	-	+	+	+	+	Ref DP-AC-397 Group Butterworth_S
34	11:29:39	20250618-1123-B500_B.14-34	11	F19_NoCPD_Day	z88883sp	-	+	-	-	-	+	+	Ref XG09c Group Romanov_A Column band 3
34	11:24:09	20250618-1123-B500_B.14-34	10	H1_Day	z88883sp	+	+	-	+	+	+	+	Ref XG09c Group Romanov_A Column band 3
32	10:58:14	20250618-1057-B500_B.14-32	10	H1_Day	z40241jm	+	+	-	+	+	+	+	Ref DJP-JIM-6-126-2b Group Procter_D
2	10:44:15	20250618-1037-B500_B.14-2	10	H1_Day	m90460ad	+	+	-	+	x	+	+	Ref mfg-ad-394-2 Group Greaney_M	Shim failed
1	10:37:52	20250618-1036-B500_B.14-1	10	H1_Day	m90460ad	+	+	-	+	+	+	+	Ref mfg-ad-394-1 Group Greaney_M
23	10:27:48	20250618-1027-B500_B.14-23	10	H1_Day	z88883sp	+	+	-	+	+	+	+	Ref SP362f1 Group Romanov_A SP362d MeOH washed, oven dried
21	10:10:20	20250618-0954-B500_B.14-21	10	H1quant_Day	q80578pk	+	+	-	+	+	+	+	Ref MJJ-PK-01-006-1305016 Group Other
20	09:54:58	20250618-0953-B500_B.14-20	10	H1quant_Day	q80578pk	+	+	-	+	+	+	+	Ref MJJ-PK-01-006-1105016 Group Other
6	09:50:20	20250618-0937-B500_B.14-6	11	F19_NoCPD_Day	c46714th	-	+	-	-	-	+	+	Ref TH-557-001-rm Group James_M
6	09:44:21	20250618-0937-B500_B.14-6	10	H1_Day	c46714th	+	+	-	+	+	+	+	Ref TH-557-001-rm Group James_M
5	09:42:20	20250618-0936-B500_B.14-5	11	F19_NoCPD_Day	c46714th	-	+	-	-	-	+	+	Ref TH-556-001-rm Group James_M
5	09:36:58	20250618-0936-B500_B.14-5	10	H1_Day	c46714th	+	+	-	+	+	+	+	Ref TH-556-001-rm Group James_M
3	08:51:22	20250618-0844-B500_B.14-3	11	H1_ExtraWide_Day	n38871ln	-	+	-	-	-	+	+	Ref ln86 16h reflux Group Larrosa_I
3	08:45:01	20250618-0844-B500_B.14-3	10	H1_Day	n38871ln	+	+	-	+	+	+	+	Ref ln86 16h reflux Group Larrosa_I
23	05:13:03	20250617-1928-B500_B.14-23	11	C13_Quant_CPD_Night	j21190dp	-	+	-	-	-	+	+	Ref akdp53 big c13 Group Keerthi_A
23	05:07:29	20250617-1928-B500_B.14-23	10	H1_Day	j21190dp	+	+	-	+	+	+	+	Ref akdp53 big h1 Group Keerthi_A
22	03:54:52	20250617-1928-B500_B.14-22	11	C13_Quant_CPD_Night	j21190dp	-	+	-	-	-	+	+	Ref akdp53 small c13 Group Keerthi_A
22	03:46:32	20250617-1928-B500_B.14-22	10	H1_Day	j21190dp	+	+	-	+	+	+	+	Ref akdp53 small h1 Group Keerthi_A
52	03:40:01	20250617-1803-B500_B.14-52	10	H1_Night	m52750pm	+	+	-	+	x	+	+	Ref GCPM52col4Fi Group Crisenza_G	Shim failed
7	02:58:07	20250617-1748-B500_B.14-7	14	H1_COSY_HiRes_Night	mbdxkrn2	-	+	-	-	-	+	+	Ref GDB-RN999 Full Char - Acetone-d6 Group DeBo_G
7	02:36:37	20250617-1748-B500_B.14-7	13	H1_C13_HSQC_Night	mbdxkrn2	-	+	-	-	-	+	+	Ref GDB-RN999 Full Char - Acetone-d6 Group DeBo_G
7	02:05:06	20250617-1748-B500_B.14-7	12	H1_C13_HMBC_Night	mbdxkrn2	-	+	-	-	-	+	+	Ref GDB-RN999 Full Char - Acetone-d6 Group DeBo_G
7	02:02:55	20250617-1748-B500_B.14-7	11	H1_Night	mbdxkrn2	-	+	-	-	-	+	+	Ref GDB-RN999 Full Char - Acetone-d6 Group DeBo_G
7	01:44:13	20250617-1748-B500_B.14-7	10	C13_CPD_Night256	mbdxkrn2	+	+	-	+	+	+	+	Ref GDB-RN999 Full Char - Acetone-d6 Group DeBo_G
13	00:27:06	20250617-1658-B500_B.14-13	11	C13_Quant_CPD_Night	a38518yl	+	+	-	+	+	+	+	Ref yl-alhatome Group Keerthi_A
30	00:05:39	20250617-1620-B500_B.14-30	12	H1_Quant_Night_T1_11s	b30323mh	-	+	-	-	-	+	+	Ref MH-TC2R9-Q test 11s Group Fielding_L
30	23:51:07	20250617-1620-B500_B.14-30	11	H1_Quant_Night_T1_6.5s	b30323mh	-	+	-	-	-	+	+	Ref MH-TC2R9-Q test 6.5s Group Fielding_L
30	23:40:37	20250617-1620-B500_B.14-30	10	H1_Quant_Night	b30323mh	+	+	-	+	+	+	+	Ref MH-TC2R9-Q test standard Group Fielding_L
5	18:01:48	20250616-1311-B500_B.14-5	17	H1_NOESY_LT	m14269jw	+	+	-	+	+	+	+	Ref IR-JW-3061-ZnTf2-Iso Group Riddell_I
46	17:59:44	20250617-1746-B500_B.14-46	12	F19_NoCPD_Day	v97511sv	-	+	-	-	-	+	+	Ref DPM-SV-56 t = 8 hours Group Mills_D [Ph3C][BArF24] + La(Cpttt)(BH4) t = 8 hours
46	17:54:02	20250617-1746-B500_B.14-46	11	C13_DEPTQ_Day	v97511sv	-	+	-	-	-	+	+	Ref DPM-SV-56 t = 8 hours Group Mills_D [Ph3C][BArF24] + La(Cpttt)(BH4) t = 8 hours
46	17:48:11	20250617-1746-B500_B.14-46	10	H1_Day	v97511sv	+	+	-	+	+	+	+	Ref DPM-SV-56 t = 8 hours Group Mills_D [Ph3C][BArF24] + La(Cpttt)(BH4) t = 8 hours
44	17:21:17	20250617-1710-B500_B.14-44	11	F19_NoCPD_Day	w52164bc	-	+	-	-	-	+	+	Ref BC-12-001 Group James_M
44	17:12:17	20250617-1710-B500_B.14-44	10	H1_Day	w52164bc	+	+	-	+	+	+	+	Ref BC-12-001 Group James_M
42	17:06:27	20250617-1702-B500_B.14-42	10	H1_Day	v43419jm	+	+	-	+	+	+	+	Ref 094fp Group Crisenza_G
13	17:00:44	20250617-1658-B500_B.14-13	10	H1_Day	a38518yl	+	+	-	+	+	+	+	Ref yl-alhatome Group Keerthi_A
12	16:55:18	20250617-1527-B500_B.14-12	11	H1_Day	n31353oc	+	+	-	+	+	+	+	Ref djp-oc-681-is Group Procter_D
11	16:36:40	20250617-1518-B500_B.14-11	11	C13_CPD_Night256	w30344xc	+	+	-	+	+	+	+	Ref xc09pf Group Keerthi_A
19	16:29:59	20250617-1616-B500_B.14-19	10	H1_Day	m90460ad	+	+	-	+	+	+	+	Ref mfg-ad-389n1 Group Greaney_M
18	16:27:46	20250617-1558-B500_B.14-18	11	H1_ExtraWide_Day	n38871ln	-	+	-	-	-	+	+	Ref ln86-1 1hr Group Larrosa_I
18	16:21:47	20250617-1558-B500_B.14-18	10	H1_Day	n38871ln	+	+	-	+	+	+	+	Ref ln86-1 1hr Group Larrosa_I
17	16:19:45	20250617-1549-B500_B.14-17	11	F19_NoCPD_Day	mbdxrbj2	-	+	-	-	-	+	+	Ref BJ518_PC Group Procter_D
17	16:13:50	20250617-1549-B500_B.14-17	10	H1_Day	mbdxrbj2	+	+	-	+	+	+	+	Ref BJ518_PC Group Procter_D
16	16:08:18	20250617-1548-B500_B.14-16	10	H1_Day	x73847lm	+	+	-	+	+	+	+	Ref Prog + TMS Group Riddell_I
15	16:02:42	20250617-1547-B500_B.14-15	10	H1_Day	x73847lm	+	+	-	+	+	+	+	Ref Chol+ TMS Group Riddell_I
14	15:56:45	20250617-1546-B500_B.14-14	10	H1_Day	x73847lm	+	+	-	+	+	+	+	Ref pyrene + TMS Group Riddell_I
13	15:43:08	20250617-1532-B500_B.14-13	10	H1quant_Day	g23544jd	+	+	-	+	+	+	+	Ref MJJ-JDL-05-004-5h Group James_M
12	15:29:50	20250617-1527-B500_B.14-12	10	H1quant_Day	g23544jd	+	+	-	+	+	+	+	Ref MJJ-JDL-05-004-3h Group James_M
11	15:24:19	20250617-1518-B500_B.14-11	10	H1_Day	w30344xc	+	+	-	+	+	+	+	Ref xc09pf Group Keerthi_A
10	15:17:30	20250617-1510-B500_B.14-10	11	H1_COSY_Day	b32507dt	-	+	-	-	-	+	+	Ref dtpyaib4sernhtbu Group Webb_S
10	15:12:19	20250617-1510-B500_B.14-10	10	H1_Day	b32507dt	+	+	-	+	+	+	+	Ref dtpyaib4sernhtbu Group Webb_S
8	15:06:48	20250617-1506-B500_B.14-8	10	H1_Day	mbyxaac2	+	+	-	+	+	+	+	Ref DP-AC-M.Li Group Butterworth_S
6	14:57:04	20250617-1456-B500_B.14-6	10	H1_Day	h91839em	+	+	-	+	+	+	+	Ref GC EM 44 C Group Crisenza_G
2	14:34:49	20250617-1252-B500_B.14-2	10	H1quant_Day	q80578pk	+	+	-	+	+	+	+	Ref MJJ-PK-01-007L Group Other
1	14:19:58	20250617-1252-B500_B.14-1	10	H1quant_Day	q80578pk	+	+	-	+	+	+	+	Ref MJJ-PK-01-006-1105024 Group Other
21	14:17:03	20250617-1251-B500_B.14-21	11	C13_CPD_Day	t13367jb	-	+	-	-	-	+	+	Ref mfg-jb-04-105-c Group Greaney_M mfg-jb-04-105-c
21	14:11:50	20250617-1251-B500_B.14-21	10	H1_Day	t13367jb	+	+	-	+	+	+	+	Ref mfg-jb-04-105-c Group Greaney_M mfg-jb-04-105-c
20	14:08:54	20250617-1250-B500_B.14-20	11	C13_CPD_Day	t13367jb	-	+	-	-	-	+	+	Ref mfg-jb-04-103-c Group Greaney_M mfg-jb-04-103-c
20	14:03:17	20250617-1250-B500_B.14-20	10	H1_Day	t13367jb	+	+	-	+	+	+	+	Ref mfg-jb-04-103-c Group Greaney_M mfg-jb-04-103-c
19	13:49:38	20250617-1022-B500_B.14-19	10	H1quant_Day	g23544jd	+	+	-	+	+	+	+	Ref MJJ-JDL-05-004-60 Group James_M
16	13:44:53	20250617-1249-B500_B.14-16	11	C13_CPD_Day	t13367jb	-	+	-	-	-	+	+	Ref mfg-jb-04-101-c Group Greaney_M mfg-jb-04-101-c
16	13:38:41	20250617-1249-B500_B.14-16	10	H1_Day	t13367jb	+	+	-	+	+	+	+	Ref mfg-jb-04-101-c Group Greaney_M mfg-jb-04-101-c
15	13:33:03	20250617-1024-B500_B.14-15	10	H1_Day	w43932ra	+	+	-	+	+	+	+	Ref RAUnkown Group Gardiner_J
14	13:27:25	20250617-1024-B500_B.14-14	10	H1_Day	w43932ra	+	+	-	+	+	+	+	Ref RA9 Group Gardiner_J
13	13:14:06	20250617-1022-B500_B.14-13	10	H1quant_Day	g23544jd	+	+	-	+	+	+	+	Ref MJJ-JDL-05-004-80 Group James_M
12	13:00:28	20250617-1022-B500_B.14-12	10	H1quant_Day	g23544jd	+	+	-	+	+	+	+	Ref MJJ-JDL-05-004-100 Group James_M
11	12:45:10	20250617-1021-B500_B.14-11	10	H1quant_Day	g23544jd	+	+	-	+	+	+	+	Ref MJJ-JDL-05-004-120 Group James_M
57	12:39:16	20250617-1236-B500_B.14-57	10	H1_Day	m52750pm	+	+	-	+	+	+	+	Ref GCPM57cru Group Crisenza_G
56	12:32:06	20250617-1229-B500_B.14-56	10	H1_Day	x73847lm	+	+	-	+	+	+	+	Ref IR-LJM-perylene with TMS Group Riddell_I
54	12:25:45	20250617-1225-B500_B.14-54	10	H1_Day	n31353oc	+	+	-	+	+	+	+	Ref djp-oc-680-is-dmso Group Procter_D	sref: reference peak not found default calibration done
10	10:11:20	20250617-1010-B500_B.14-10	10	H1quant_Day	q80578pk	+	+	-	+	+	+	+	Ref MJJ-PK-01-006-1105016 Group Other	Automation was stopped by user
48	10:01:53	20250617-0952-B500_B.14-48	10	H1_Day	n31353oc	+	+	-	+	+	+	+	Ref djp-oc-670-dmso Group Procter_D
46	09:59:48	20250617-0945-B500_B.14-46	12	F19_NoCPD_Day	v97511sv	-	+	-	-	-	+	+	Ref DPM-SV-56 t = 0 Group Mills_D [Ph3C][BArF24] + La(Cpttt)2(BH4) C6D6 t = 0
46	09:55:06	20250617-0945-B500_B.14-46	11	C13_DEPTQ_Day	v97511sv	-	+	-	-	-	+	+	Ref DPM-SV-56 t = 0 Group Mills_D [Ph3C][BArF24] + La(Cpttt)2(BH4) C6D6 t = 0
46	09:49:24	20250617-0945-B500_B.14-46	10	H1_Day	v97511sv	+	+	-	+	+	+	+	Ref DPM-SV-56 t = 0 Group Mills_D [Ph3C][BArF24] + La(Cpttt)2(BH4) C6D6 t = 0
44	09:42:58	20250617-0942-B500_B.14-44	10	H1_Day	u67812sg	+	+	-	+	+	+	+	Ref sq-01-113 Group Procter_D
52	09:27:03	20250617-0919-B500_B.14-52	10	H1_Day	m52750pm	+	+	-	+	+	+	+	Ref GCPM52col3F2 Group Crisenza_G
51	09:20:59	20250617-0919-B500_B.14-51	10	H1_Day	m52750pm	+	+	-	+	+	+	+	Ref GCPM52col3F1 Group Crisenza_G
39	08:32:58	20250617-0825-B500_B.14-39	10	H1_Day	h55599rb	+	+	-	+	+	+	+	Ref RB-9-529.3B Group Procter_D
38	08:25:48	20250617-0825-B500_B.14-38	10	H1_Day	h55599rb	+	+	-	+	+	+	+	Ref RB-9-529.3A Group Procter_D
5	05:15:40	20250616-1311-B500_B.14-5	16	H1_C13_HMBC_Night	m14269jw	-	+	-	-	-	+	+	Ref IR-JW-3061-ZnTf2-Iso Group Riddell_I
5	04:54:02	20250616-1311-B500_B.14-5	15	H1_C13_HSQC_Night	m14269jw	-	+	-	-	-	+	+	Ref IR-JW-3061-ZnTf2-Iso Group Riddell_I
5	04:12:04	20250616-1311-B500_B.14-5	14	H1_COSY_HiRes_Night	m14269jw	-	+	-	-	-	+	+	Ref IR-JW-3061-ZnTf2-Iso Group Riddell_I
5	03:44:32	20250616-1311-B500_B.14-5	13	C13_DEPT135_Night	m14269jw	-	+	-	-	-	+	+	Ref IR-JW-3061-ZnTf2-Iso Group Riddell_I
5	03:29:39	20250616-1311-B500_B.14-5	12	C13_CPD_Night256	m14269jw	-	+	-	-	-	+	+	Ref IR-JW-3061-ZnTf2-Iso Group Riddell_I
5	03:22:58	20250616-1311-B500_B.14-5	11	H1_Night	m14269jw	+	+	-	+	+	+	+	Ref IR-JW-3061-ZnTf2-Iso Group Riddell_I
18	03:20:05	20250616-1438-B500_B.14-18	16	C13_DEPT135_Day	v43419jm	-	+	-	-	-	+	+	Ref 094fp Group Crisenza_G
18	02:48:36	20250616-1438-B500_B.14-18	15	H1_C13_HMBC_Night	v43419jm	-	+	-	-	-	+	+	Ref 094fp Group Crisenza_G
18	02:27:03	20250616-1438-B500_B.14-18	14	H1_C13_HSQC_Night	v43419jm	-	+	-	-	-	+	+	Ref 094fp Group Crisenza_G
18	01:45:13	20250616-1438-B500_B.14-18	13	H1_COSY_HiRes_Night	v43419jm	-	+	-	-	-	+	+	Ref 094fp Group Crisenza_G
18	01:17:41	20250616-1438-B500_B.14-18	12	C13_DEPT135_Night	v43419jm	-	+	-	-	-	+	+	Ref 094fp Group Crisenza_G
18	01:03:14	20250616-1438-B500_B.14-18	11	C13_CPD_Night256	v43419jm	-	+	-	-	-	+	+	Ref 094fp Group Crisenza_G
18	00:56:52	20250616-1438-B500_B.14-18	10	H1_Night	v43419jm	+	+	-	+	+	+	+	Ref 094fp Group Crisenza_G
21	00:35:22	20250616-1436-B500_B.14-21	13	H1_C13_HSQC_Night	z86427mk	-	+	-	-	-	+	+	Ref MK-Ph Enam. Group Procter_D
21	00:07:30	20250616-1436-B500_B.14-21	12	C13_DEPT135_Night	z86427mk	-	+	-	-	-	+	+	Ref MK-Ph Enam. Group Procter_D
21	23:52:58	20250616-1436-B500_B.14-21	11	C13_CPD_Night256	z86427mk	-	+	-	-	-	+	+	Ref MK-Ph Enam. Group Procter_D
21	23:47:04	20250616-1436-B500_B.14-21	10	H1_Night	z86427mk	+	+	-	+	+	+	+	Ref MK-Ph Enam. Group Procter_D
20	23:40:01	20250616-1436-B500_B.14-20	14	F19_NoCPD_Night	z86427mk	-	+	-	-	-	+	+	Ref MK-067 Group Procter_D
20	23:18:30	20250616-1436-B500_B.14-20	13	H1_C13_HSQC_Night	z86427mk	-	+	-	-	-	+	+	Ref MK-067 Group Procter_D
20	22:50:59	20250616-1436-B500_B.14-20	12	C13_DEPT135_Night	z86427mk	-	+	-	-	-	+	+	Ref MK-067 Group Procter_D
20	22:36:33	20250616-1436-B500_B.14-20	11	C13_CPD_Night256	z86427mk	-	+	-	-	-	+	+	Ref MK-067 Group Procter_D
20	22:31:04	20250616-1436-B500_B.14-20	10	H1_Night	z86427mk	+	+	-	+	+	+	+	Ref MK-067 Group Procter_D
19	22:09:27	20250616-1435-B500_B.14-19	13	H1_C13_HSQC_Night	z86427mk	-	+	-	-	-	+	+	Ref MK-103 Group Procter_D
19	21:41:54	20250616-1435-B500_B.14-19	12	C13_DEPT135_Night	z86427mk	-	+	-	-	-	+	+	Ref MK-103 Group Procter_D
19	21:27:26	20250616-1435-B500_B.14-19	11	C13_CPD_Night256	z86427mk	-	+	-	-	-	+	+	Ref MK-103 Group Procter_D
19	21:21:48	20250616-1435-B500_B.14-19	10	H1_Night	z86427mk	+	+	-	+	+	+	+	Ref MK-103 Group Procter_D
43	20:54:18	20250616-1111-B500_B.14-43	14	C13_DEPT135_Night	g23544jd	-	+	-	-	-	+	+	Ref MJJ-JDL-04-417-Bot Group James_M
43	20:22:50	20250616-1111-B500_B.14-43	13	H1_C13_HMBC_Night	g23544jd	-	+	-	-	-	+	+	Ref MJJ-JDL-04-417-Bot Group James_M
43	20:01:19	20250616-1111-B500_B.14-43	12	H1_C13_HSQC_Night	g23544jd	-	+	-	-	-	+	+	Ref MJJ-JDL-04-417-Bot Group James_M
43	19:46:52	20250616-1111-B500_B.14-43	11	C13_CPD_Night256	g23544jd	-	+	-	-	-	+	+	Ref MJJ-JDL-04-417-Bot Group James_M
43	19:41:43	20250616-1111-B500_B.14-43	10	H1_Night	g23544jd	+	+	-	+	+	+	+	Ref MJJ-JDL-04-417-Bot Group James_M
42	19:14:17	20250616-1111-B500_B.14-42	14	C13_DEPT135_Night	g23544jd	-	+	-	-	-	+	+	Ref MJJ-JDL-04-417-Top Group James_M
42	18:42:48	20250616-1111-B500_B.14-42	13	H1_C13_HMBC_Night	g23544jd	-	+	-	-	-	+	+	Ref MJJ-JDL-04-417-Top Group James_M
42	18:21:11	20250616-1111-B500_B.14-42	12	H1_C13_HSQC_Night	g23544jd	-	+	-	-	-	+	+	Ref MJJ-JDL-04-417-Top Group James_M
42	18:06:43	20250616-1111-B500_B.14-42	11	C13_CPD_Night256	g23544jd	-	+	-	-	-	+	+	Ref MJJ-JDL-04-417-Top Group James_M
42	18:00:36	20250616-1111-B500_B.14-42	10	H1_Night	g23544jd	+	+	-	+	+	+	+	Ref MJJ-JDL-04-417-Top Group James_M
10	17:42:46	20250616-1740-B500_B.14-10	10	H1_Day	v97511sv	+	+	-	+	+	+	+	Ref DPM-SV-C6D6_16_06_25 Group Mills_D
25	17:40:35	20250616-1509-B500_B.14-25	11	C13_CPD_Night256	u67812sg	x	-	-	-	-	-	-	Ref sq-01-014 Group Procter_D	Sample Changer: Error: SKIP_SAMPLE :: Error: No sample in position 25
9	17:22:14	20250616-1154-B500_B.14-9	11	C13_CPD_Night256	w30344xc	+	+	-	+	+	+	+	Ref xc07p Group Keerthi_A
3	17:04:04	20250616-1109-B500_B.14-3	11	C13_CPD_Night256	b32507dt	+	+	-	+	+	+	+	Ref JT03 (F7-F16) Group Webb_S
22	16:48:53	20250616-1647-B500_B.14-22	10	H1quant_Day	q80578pk	+	+	-	+	+	+	+	Ref MJJ-PK-01-006-1105006 Group Other
37	16:43:04	20250616-1622-B500_B.14-37	10	H1_Day	h91839em	+	+	-	+	+	+	+	Ref GC EM 36 F2 Group Crisenza_G
36	16:37:07	20250616-1622-B500_B.14-36	10	H1_Day	h91839em	+	+	-	+	+	+	+	Ref GC EM 36 F1 Group Crisenza_G
34	16:18:59	20250616-1607-B500_B.14-34	10	C13_CPD_Night256	u67812sg	+	+	-	+	+	+	+	Ref sq-01-014 Group Procter_D
33	16:15:54	20250616-1605-B500_B.14-33	11	C13_CPD_Day	u67812sg	-	+	-	-	-	+	+	Ref sq-01-115-3 Group Procter_D
33	16:10:13	20250616-1605-B500_B.14-33	10	H1_Day	u67812sg	+	+	-	+	+	+	+	Ref sq-01-115-3 Group Procter_D
32	16:04:47	20250616-1603-B500_B.14-32	10	H1_Day	n31353oc	+	+	-	+	+	+	+	Ref djp-oc-673-b Group Procter_D
30	15:58:17	20250616-1547-B500_B.14-30	10	H1_Day	p69174hv	+	+	-	+	+	+	+	Ref GC-HV Cy14 P4.1 Group Crisenza_G
29	15:52:36	20250616-1548-B500_B.14-29	10	H1_Day	n38871ln	+	+	-	+	+	+	+	Ref ln83-2 Group Larrosa_I
28	15:49:36	20250616-1511-B500_B.14-28	11	C13_CPD_Day	q85514th	-	+	-	-	-	+	+	Ref 1101DI-Ns Group Greaney_M
28	15:43:45	20250616-1511-B500_B.14-28	10	H1_Day	q85514th	+	+	-	+	+	+	+	Ref 1101DI-Ns Group Greaney_M
27	15:40:39	20250616-1511-B500_B.14-27	11	C13_CPD_Day	q85514th	-	+	-	-	-	+	+	Ref 1101DI-P Group Greaney_M
27	15:34:13	20250616-1511-B500_B.14-27	10	H1_Day	q85514th	+	+	-	+	+	+	+	Ref 1101DI-P Group Greaney_M
26	15:29:15	20250616-1510-B500_B.14-26	10	F19_NoCPD_Day	u67812sg	+	+	-	+	+	+	+	Ref sq-01-113 Group Procter_D
25	15:22:31	20250616-1509-B500_B.14-25	10	H1_Day	u67812sg	+	+	-	+	+	+	+	Ref sq-01-014 Group Procter_D
24	15:17:06	20250616-1450-B500_B.14-24	11	H1_WaterSupp_Day	m14269jw	-	+	-	-	-	+	+	Ref IR-JW-3058-2to1D2OtoMeCN Group Riddell_I
24	15:10:19	20250616-1450-B500_B.14-24	10	H1_Day	m14269jw	+	+	-	+	+	+	+	Ref IR-JW-3058-2to1D2OtoMeCN Group Riddell_I
23	15:08:20	20250616-1456-B500_B.14-23	11	F19_NoCPD_Day	n38871ln	-	+	-	-	-	+	+	Ref ln84 ruaqua Group Larrosa_I
23	15:02:18	20250616-1456-B500_B.14-23	10	H1_Day	n38871ln	+	+	-	+	+	+	+	Ref ln84 ruaqua Group Larrosa_I
22	14:47:33	20250616-1419-B500_B.14-22	10	H1quant_Day	q80578pk	+	+	-	+	+	+	+	Ref MJJ-PK-01-009-905348 Group Other
17	14:44:33	20250616-1423-B500_B.14-17	11	C13_CPD_Day	q49270na	-	+	-	-	-	+	+	Ref na-37 Group Greaney_M
17	14:38:43	20250616-1423-B500_B.14-17	10	H1_Day	q49270na	+	+	-	+	+	+	+	Ref na-37 Group Greaney_M
14	14:35:35	20250616-1421-B500_B.14-14	11	C13_CPD_Day	q49270na	-	+	-	-	-	+	+	Ref na-38 Group Greaney_M
14	14:28:25	20250616-1421-B500_B.14-14	10	H1_Day	q49270na	+	+	-	+	+	+	+	Ref na-38 Group Greaney_M
13	14:25:23	20250616-1412-B500_B.14-13	11	C13_CPD_Day	v43419jm	-	+	-	-	-	+	+	Ref 096cp Group Crisenza_G
13	14:18:49	20250616-1412-B500_B.14-13	10	H1_Day	v43419jm	+	+	-	+	+	+	+	Ref 096cp Group Crisenza_G
11	14:13:32	20250616-1334-B500_B.14-11	10	F19_NoCPD_Day	u67812sg	+	+	-	+	+	+	+	Ref sq-01-113 Group Procter_D
10	14:08:20	20250616-1334-B500_B.14-10	10	H1_Day	u67812sg	+	+	-	+	+	+	+	Ref sq-01-014 Group Procter_D
8	14:02:14	20250616-1335-B500_B.14-8	10	H1_Day	u67812sg	+	+	-	+	+	+	+	Ref sq-01-115-3 Group Procter_D
7	13:55:37	20250616-1331-B500_B.14-7	10	H1_Day	u67812sg	+	+	-	+	+	+	+	Ref sq-01-114 Group Procter_D
6	13:52:33	20250616-1326-B500_B.14-6	11	C13_CPD_Day	q85514th	-	+	-	-	-	+	+	Ref 1201DI-Ns P Group Greaney_M
6	13:46:06	20250616-1326-B500_B.14-6	10	H1_Day	q85514th	+	+	-	+	+	+	+	Ref 1201DI-Ns P Group Greaney_M
5	13:40:00	20250616-1311-B500_B.14-5	10	H1_Day	m14269jw	+	+	-	+	+	+	+	Ref IR-JW-3061-ZnTf2-Iso Group Riddell_I
4	13:37:01	20250616-1306-B500_B.14-4	11	C13_CPD_Day	q85514th	-	+	-	-	-	+	+	Ref 2601DI-Ns Group Greaney_M
4	13:31:14	20250616-1306-B500_B.14-4	10	H1_Day	q85514th	+	+	-	+	+	+	+	Ref 2601DI-Ns Group Greaney_M
2	13:28:17	20250616-1306-B500_B.14-2	11	C13_CPD_Day	q85514th	-	+	-	-	-	+	+	Ref 2601DI-P Group Greaney_M
2	13:22:19	20250616-1306-B500_B.14-2	10	H1_Day	q85514th	+	+	-	+	+	+	+	Ref 2601DI-P Group Greaney_M
1	13:04:29	20250616-1104-B500_B.14-1	11	C13_CPD_Night256	b32507dt	+	+	-	+	+	+	+	Ref JT03 (F4-F6) Group Webb_S
16	12:59:11	20250616-1258-B500_B.14-16	10	H1_Day	m09677nb	+	+	-	+	+	+	+	Ref py ome Group Greaney_M
15	12:55:30	20250616-1140-B500_B.14-15	11	C13_CPD_Day	p69174hv	-	+	-	-	-	+	+	Ref GC-HV Cy14 P Group Crisenza_G
15	12:48:21	20250616-1140-B500_B.14-15	10	H1_Day	p69174hv	+	+	-	+	+	+	+	Ref GC-HV Cy14 P Group Crisenza_G
12	12:41:41	20250616-1208-B500_B.14-12	10	H1_Day	m10213pw	+	+	-	+	+	+	+	Ref SJW-PY1.1 Group Webb_S
11	12:35:59	20250616-1200-B500_B.14-11	10	H1_ExtraWide_Day	e14150oc	+	+	-	+	+	+	+	Ref oc_carb+ring_exchange(1) Group Winpenny_R
10	12:32:51	20250616-1158-B500_B.14-10	11	C13_CPD_Day	m75418lc	-	+	-	-	-	+	+	Ref LC LN 8 Group Natrajan_L
10	12:27:48	20250616-1158-B500_B.14-10	10	H1_Day	m75418lc	+	+	-	+	+	+	+	Ref LC LN 8 Group Natrajan_L
9	12:22:25	20250616-1154-B500_B.14-9	10	H1_Day	w30344xc	+	+	-	+	+	+	+	Ref xc07p Group Keerthi_A
8	12:17:11	20250616-1153-B500_B.14-8	10	H1_Day	j34309ms	+	+	-	+	+	+	+	Ref ph-dip-cdcl3 Group Mills_D
7	12:11:36	20250616-1151-B500_B.14-7	10	H1_Day	j34309ms	+	+	-	+	+	+	+	Ref 2,6-ipr-dip-cdcl3 Group Mills_D
6	12:05:35	20250616-1144-B500_B.14-6	10	H1_Day	u67812sg	+	+	-	+	+	+	+	Ref sq-01-115-2 Group Procter_D
5	12:00:01	20250616-1145-B500_B.14-5	10	H1_Day	u67812sg	+	+	-	+	+	+	+	Ref sq-01-115-1 Group Procter_D
4	11:54:21	20250616-1141-B500_B.14-4	10	H1_Day	z40241jm	+	+	-	+	+	+	+	Ref DJP-JIM-6-128-amide Group Procter_D
2	11:48:14	20250616-1139-B500_B.14-2	11	H1_COSY_Day	n38871ln	-	+	-	-	-	+	+	Ref o-toly phpy Group Larrosa_I
2	11:41:56	20250616-1139-B500_B.14-2	10	H1_Day	n38871ln	+	+	-	+	+	+	+	Ref o-toly phpy Group Larrosa_I
1	11:35:06	20250616-1104-B500_B.14-1	10	H1_Day	b32507dt	+	+	-	+	+	+	+	Ref JT03 (F4-F6) Group Webb_S
11	11:28:00	20250616-1121-B500_B.14-11	10	H1_Day	p87239xt	+	+	-	+	+	+	+	Ref nl-xyt-meod Group Natrajan_L
5	11:22:16	20250616-1119-B500_B.14-5	10	H1_Day	x25009jo	+	+	-	+	+	+	+	Ref GDB-JO-Ushape TFA Group DeBo_G
3	11:16:15	20250616-1109-B500_B.14-3	10	H1_Day	b32507dt	+	+	-	+	+	+	+	Ref JT03 (F7-F16) Group Webb_S
2	11:09:20	20250616-1108-B500_B.14-2	10	H1_Day	b32507dt	+	+	-	+	+	+	+	Ref JT03 (F21-F30) Group Webb_S
56	10:53:54	20250616-1052-B500_B.14-56	10	H1_Day	p87239xt	+	+	-	+	+	+	+	Ref nl-xyt-meod Group Natrajan_L
54	10:47:58	20250616-1045-B500_B.14-54	10	H1_Day	y59240mb	+	+	-	+	+	+	+	Ref 50 microlid oegma in 650 microlid chloroform Group McDonald_T 50 microlid oegma in 650 microlid chloroform
60	10:40:58	20250616-1038-B500_B.14-60	1	H1_Day	y59240mb	+	+	-	+	+	+	+	Ref MEO2mA in CHLO Group McDonald_T 50 microlid MEO2mA in 650 microlid chlorofprm
54	10:34:41	20250613-1602-B500_B.14-52	20	H1_Day	y59240mb	x	-	-	-	-	-	-	Ref 50 microlit oegma in 650 microlit chloroform Group McDonald_T 50 microlit oegma in 650 microlit chloroform	Sample Changer: Error: SKIP_SAMPLE :: Error: No sample in position 54
59	10:04:59	20250616-0949-B500_B.14-59	11	F19_NoCPD_Day	w52164bc	-	+	-	-	-	+	+	Ref BC-08-220 P2 Group James_M
59	09:58:07	20250616-0949-B500_B.14-59	10	H1_Day	w52164bc	+	+	-	+	+	+	+	Ref BC-08-220 P2 Group James_M
58	09:55:41	20250616-0949-B500_B.14-58	11	F19_NoCPD_Day	w52164bc	-	+	-	-	-	+	+	Ref BC-08-220 P1 Group James_M
58	09:49:34	20250616-0949-B500_B.14-58	10	H1_Day	w52164bc	+	+	-	+	+	+	+	Ref BC-08-220 P1 Group James_M
10	09:43:57	20250616-0937-B500_B.14-10	11	C13_CPD_Day	j45159ks	-	+	-	-	-	+	+	Ref 130_column Group Keerthi_A
10	09:38:28	20250616-0937-B500_B.14-10	10	H1_Day	j45159ks	+	+	-	+	+	+	+	Ref 130_column Group Keerthi_A
9	09:29:38	20250616-0916-B500_B.14-9	10	H1_Day	d47555aa	+	+	-	+	+	+	+	Ref DJP-ASA-1154 prod mixed Group Procter_D
8	09:24:03	20250616-0914-B500_B.14-8	10	H1_Day	c39014ab	+	+	-	+	+	+	+	Ref ab-pyr-m-no2-check Group Leigh_D ab-pyr-m-no2-check
7	09:16:10	20250616-0914-B500_B.14-7	10	H1_Day	c39014ab	+	+	-	+	+	+	+	Ref ab-pyr-o-no2-check Group Leigh_D ab-pyr-o-no2-check
6	08:47:58	20250616-0841-B500_B.14-5	20	H1_Day	z40241jm	+	+	-	+	+	+	+	Ref DJP-JIM-6-126-amide Group Procter_D
5	08:41:43	20250616-0841-B500_B.14-5	10	H1_Day	z40241jm	+	+	-	+	+	+	+	Ref DJP-JIM-6-126-bromide Group Procter_D
1	08:24:26	20250616-0817-B500_B.14-1	11	H1quant_Day	n38871ln	-	+	-	-	-	+	+	Ref ln84 weekend Group Larrosa_I
1	08:18:08	20250616-0817-B500_B.14-1	10	H1_Day	n38871ln	+	+	-	+	+	+	+	Ref ln84 weekend Group Larrosa_I
14	22:52:02	20250615-2229-B500_B.14-14	12	C13_DEPT135_Day	a74776dr	-	+	-	-	-	+	+	Ref DJP-DR-1-257-2 Group Procter_D
14	22:37:35	20250615-2229-B500_B.14-14	11	C13_CPD_Night256	a74776dr	-	+	-	-	-	+	+	Ref DJP-DR-1-257-2 Group Procter_D
14	22:30:53	20250615-2229-B500_B.14-14	10	H1_Night	a74776dr	+	+	-	+	+	+	+	Ref DJP-DR-1-257-2 Group Procter_D
13	20:58:52	20250615-1826-B500_B.14-13	15	H1_C13_HMBC_Night	u67812sg	-	+	-	-	-	+	+	Ref sq-01-080 Group Procter_D
13	20:37:16	20250615-1826-B500_B.14-13	14	H1_C13_HSQC_Night	u67812sg	-	+	-	-	-	+	+	Ref sq-01-080 Group Procter_D
13	19:55:21	20250615-1826-B500_B.14-13	13	H1_COSY_HiRes_Night	u67812sg	-	+	-	-	-	+	+	Ref sq-01-080 Group Procter_D
13	19:27:53	20250615-1826-B500_B.14-13	12	C13_DEPT135_Night	u67812sg	-	+	-	-	-	+	+	Ref sq-01-080 Group Procter_D
13	19:13:27	20250615-1826-B500_B.14-13	11	C13_CPD_Night256	u67812sg	-	+	-	-	-	+	+	Ref sq-01-080 Group Procter_D
13	19:07:49	20250615-1826-B500_B.14-13	10	H1_Night	u67812sg	+	+	-	+	+	+	+	Ref sq-01-080 Group Procter_D
12	18:52:22	20250615-1825-B500_B.14-12	12	C13_CPD_Night256	u67812sg	-	+	-	-	-	+	+	Ref sq-01-014 Group Procter_D
12	18:50:28	20250615-1825-B500_B.14-12	11	F19_NoCPD_Day	u67812sg	-	+	-	-	-	+	+	Ref sq-01-014 Group Procter_D
12	18:44:19	20250615-1825-B500_B.14-12	10	H1_Day	u67812sg	+	+	-	+	+	+	+	Ref sq-01-014 Group Procter_D
11	18:38:07	20250615-1825-B500_B.14-11	10	H1_Day	u67812sg	+	+	-	+	+	+	+	Ref sq-01-115-3 Group Procter_D
10	18:31:26	20250615-1825-B500_B.14-10	10	H1_Day	u67812sg	+	+	-	+	+	+	+	Ref sq-01-115-2 Group Procter_D
9	18:25:16	20250615-1824-B500_B.14-9	10	H1_Day	u67812sg	+	+	-	+	+	+	+	Ref sq-01-115-1 Group Procter_D
5	17:43:52	20250615-1721-B500_B.14-5	12	C13_DEPT135_Day	a74776dr	-	+	-	-	-	+	+	Ref DJP-DR-1-258-cr after 18 h Group Procter_D
5	17:29:17	20250615-1721-B500_B.14-5	11	C13_CPD_Night256	a74776dr	-	+	-	-	-	+	+	Ref DJP-DR-1-258-cr after 18 h Group Procter_D
5	17:22:43	20250615-1721-B500_B.14-5	10	H1_Night	a74776dr	+	+	-	+	+	+	+	Ref DJP-DR-1-258-cr after 18 h Group Procter_D
4	16:55:26	20250615-1640-B500_B.14-4	11	C13_CPD_Day	u67812sg	-	+	-	-	-	+	+	Ref sq-01-080 Group Procter_D
4	16:49:29	20250615-1640-B500_B.14-4	10	H1_Day	u67812sg	+	+	-	+	+	+	+	Ref sq-01-080 Group Procter_D
3	16:46:33	20250615-1640-B500_B.14-3	11	C13_CPD_Day	u67812sg	-	+	-	-	-	+	+	Ref sq-01-079 Group Procter_D
3	16:40:57	20250615-1640-B500_B.14-3	10	H1_Day	u67812sg	+	+	-	+	+	+	+	Ref sq-01-079 Group Procter_D
25	21:52:43	20250614-1916-B500_B.14-23	27	H1_C13_HMBC_Night	a74776dr	-	+	-	-	-	+	+	Ref DJP-DR-1-257-2 Group Procter_D
25	21:31:10	20250614-1916-B500_B.14-23	26	H1_C13_HSQC_Night	a74776dr	-	+	-	-	-	+	+	Ref DJP-DR-1-257-2 Group Procter_D
25	20:49:13	20250614-1916-B500_B.14-23	25	H1_COSY_HiRes_Night	a74776dr	-	+	-	-	-	+	+	Ref DJP-DR-1-257-2 Group Procter_D
25	20:46:20	20250614-1916-B500_B.14-23	22	C13_DEPT135_Day	a74776dr	-	+	-	-	-	+	+	Ref DJP-DR-1-257-2 Group Procter_D
25	20:31:54	20250614-1916-B500_B.14-23	21	C13_CPD_Night256	a74776dr	-	+	-	-	-	+	+	Ref DJP-DR-1-257-2 Group Procter_D
25	20:25:58	20250614-1916-B500_B.14-23	20	H1_Night	a74776dr	+	+	-	+	+	+	+	Ref DJP-DR-1-257-2 Group Procter_D
23	19:37:53	20250614-1916-B500_B.14-23	12	C13_DEPT135_Day	a74776dr	-	+	-	-	-	+	+	Ref DJP-DR-1-257-1 Group Procter_D
23	19:23:26	20250614-1916-B500_B.14-23	11	C13_CPD_Night256	a74776dr	-	+	-	-	-	+	+	Ref DJP-DR-1-257-1 Group Procter_D
23	19:18:00	20250614-1916-B500_B.14-23	10	H1_Night	a74776dr	+	+	-	+	+	+	+	Ref DJP-DR-1-257-1 Group Procter_D
59	15:56:38	20250614-1534-B500_B.14-59	11	H1quant_Day	n38871ln	-	+	-	-	-	+	+	Ref ln84-1 cdcl3 Group Larrosa_I
59	15:50:30	20250614-1534-B500_B.14-59	10	H1_Day	n38871ln	+	+	-	+	+	+	+	Ref ln84-1 cdcl3 Group Larrosa_I
58	15:40:21	20250614-1533-B500_B.14-58	11	H1quant_Day	n38871ln	-	+	-	-	-	+	+	Ref ln84-1 acetone Group Larrosa_I
58	15:34:02	20250614-1533-B500_B.14-58	10	H1_Day	n38871ln	+	+	-	+	+	+	+	Ref ln84-1 acetone Group Larrosa_I
13	15:02:17	20250614-1454-B500_B.14-13	12	H1quant_Day	n38871ln	-	+	-	-	-	+	+	Ref ln84-1 3 h Group Larrosa_I
13	15:00:32	20250614-1454-B500_B.14-13	11	H1_ExtraWide_Day	n38871ln	-	+	-	-	-	+	+	Ref ln84-1 3 h Group Larrosa_I
13	14:54:45	20250614-1454-B500_B.14-13	10	H1_Day	n38871ln	+	+	-	+	+	+	+	Ref ln84-1 3 h Group Larrosa_I
11	14:07:38	20250614-1331-B500_B.14-11	10	H1_Day	z86427mk	+	+	-	+	+	+	+	Ref MK-007 QC Group Procter_D
2	14:04:01	20250614-1357-B500_B.14-2	11	H1_ExtraWide_Day	n38871ln	-	+	-	-	-	+	+	Ref ln84-1 2 h Group Larrosa_I
2	13:57:55	20250614-1357-B500_B.14-2	10	H1_Day	n38871ln	+	+	-	+	+	+	+	Ref ln84-1 2 h Group Larrosa_I
9	13:00:28	20250614-1253-B500_B.14-9	11	H1_ExtraWide_Day	n38871ln	-	+	-	-	-	+	+	Ref ln84-1 1 h Group Larrosa_I
9	12:54:12	20250614-1253-B500_B.14-9	10	H1_Day	n38871ln	+	+	-	+	+	+	+	Ref ln84-1 1 h Group Larrosa_I
4	12:15:15	20250614-1209-B500_B.14-4	11	H1_ExtraWide_Day	n38871ln	-	+	-	-	-	+	+	Ref ln84-1 15 min Group Larrosa_I
4	12:09:44	20250614-1209-B500_B.14-4	10	H1_Day	n38871ln	+	+	-	+	+	+	+	Ref ln84-1 15 min Group Larrosa_I
1	11:37:36	20250614-1130-B500_B.14-1	11	H1_ExtraWide_Day	n38871ln	-	+	-	-	-	+	+	Ref ln84-1 overnight Group Larrosa_I
1	11:30:58	20250614-1130-B500_B.14-1	10	H1_Day	n38871ln	+	+	-	+	+	+	+	Ref ln84-1 overnight Group Larrosa_I
27	07:11:37	20250613-1619-B500_B.14-27	11	C13_CPD_Night256	q85514th	+	+	-	+	+	+	+	Ref 130XDI-Ns Group Greaney_M
26	06:54:02	20250613-1618-B500_B.14-26	11	C13_CPD_Night256	q85514th	+	+	-	+	+	+	+	Ref 400XDI-Ns Group Greaney_M
25	06:36:24	20250613-1617-B500_B.14-25	11	C13_CPD_Night256	q85514th	+	+	-	+	+	+	+	Ref 400XDI-P Group Greaney_M
21	06:18:34	20250613-1616-B500_B.14-21	11	C13_CPD_Night256	q85514th	+	+	-	+	+	+	+	Ref 170XDI-Ns Group Greaney_M
20	05:58:50	20250613-1616-B500_B.14-20	11	C13_CPD_Night256	q85514th	+	+	-	+	+	+	+	Ref 170XDI-P Group Greaney_M
49	05:15:48	20250612-1057-B500_B.14-49	12	H1_COSY_HiRes_Night	z40973rs	-	+	-	-	-	+	+	Ref gdb-rs-97 wash Group DeBo_G
49	05:01:28	20250612-1057-B500_B.14-49	11	H1_Night128	z40973rs	+	+	-	+	+	+	+	Ref gdb-rs-97 wash Group DeBo_G
18	04:34:03	20250611-1407-B500_B.14-18	17	C13_DEPT135_Night	v43419jm	-	+	-	-	-	+	+	Ref 093fp Group Crisenza_G
18	04:02:29	20250611-1407-B500_B.14-18	16	H1_C13_HMBC_Night	v43419jm	-	+	-	-	-	+	+	Ref 093fp Group Crisenza_G
18	03:40:57	20250611-1407-B500_B.14-18	15	H1_C13_HSQC_Night	v43419jm	-	+	-	-	-	+	+	Ref 093fp Group Crisenza_G
18	02:59:06	20250611-1407-B500_B.14-18	14	H1_COSY_HiRes_Night	v43419jm	-	+	-	-	-	+	+	Ref 093fp Group Crisenza_G
18	02:31:40	20250611-1407-B500_B.14-18	13	C13_DEPT135_Night	v43419jm	-	+	-	-	-	+	+	Ref 093fp Group Crisenza_G
18	02:17:13	20250611-1407-B500_B.14-18	12	C13_CPD_Night256	v43419jm	-	+	-	-	-	+	+	Ref 093fp Group Crisenza_G
18	02:10:43	20250611-1407-B500_B.14-18	11	H1_Night	v43419jm	+	+	-	+	+	+	+	Ref 093fp Group Crisenza_G
30	01:39:12	20250611-1739-B500_B.14-30	15	H1_C13_HMBC_Night	j40457bh	-	+	-	-	-	+	+	Ref bh4-11 fc Group Trowbridge_A
30	01:17:40	20250611-1739-B500_B.14-30	14	H1_C13_HSQC_Night	j40457bh	-	+	-	-	-	+	+	Ref bh4-11 fc Group Trowbridge_A
30	00:35:42	20250611-1739-B500_B.14-30	13	H1_COSY_HiRes_Night	j40457bh	-	+	-	-	-	+	+	Ref bh4-11 fc Group Trowbridge_A
30	00:08:12	20250611-1739-B500_B.14-30	12	C13_DEPT135_Night	j40457bh	-	+	-	-	-	+	+	Ref bh4-11 fc Group Trowbridge_A
30	23:53:39	20250611-1739-B500_B.14-30	11	C13_CPD_Night256	j40457bh	-	+	-	-	-	+	+	Ref bh4-11 fc Group Trowbridge_A
30	23:48:24	20250611-1739-B500_B.14-30	10	H1_Night	j40457bh	+	+	-	+	+	+	+	Ref bh4-11 fc Group Trowbridge_A
29	23:16:49	20250611-1738-B500_B.14-29	15	H1_C13_HMBC_Night	j40457bh	-	+	-	-	-	+	+	Ref bh3-172 fc Group Trowbridge_A
29	22:55:17	20250611-1738-B500_B.14-29	14	H1_C13_HSQC_Night	j40457bh	-	+	-	-	-	+	+	Ref bh3-172 fc Group Trowbridge_A
29	22:13:19	20250611-1738-B500_B.14-29	13	H1_COSY_HiRes_Night	j40457bh	-	+	-	-	-	+	+	Ref bh3-172 fc Group Trowbridge_A
29	21:45:53	20250611-1738-B500_B.14-29	12	C13_DEPT135_Night	j40457bh	-	+	-	-	-	+	+	Ref bh3-172 fc Group Trowbridge_A
29	21:31:26	20250611-1738-B500_B.14-29	11	C13_CPD_Night256	j40457bh	-	+	-	-	-	+	+	Ref bh3-172 fc Group Trowbridge_A
29	21:26:13	20250611-1738-B500_B.14-29	10	H1_Night	j40457bh	+	+	-	+	+	+	+	Ref bh3-172 fc Group Trowbridge_A
28	20:54:42	20250611-1738-B500_B.14-28	15	H1_C13_HMBC_Night	j40457bh	-	+	-	-	-	+	+	Ref bh4-19 fc Group Trowbridge_A
28	20:33:07	20250611-1738-B500_B.14-28	14	H1_C13_HSQC_Night	j40457bh	-	+	-	-	-	+	+	Ref bh4-19 fc Group Trowbridge_A
28	19:51:14	20250611-1738-B500_B.14-28	13	H1_COSY_HiRes_Night	j40457bh	-	+	-	-	-	+	+	Ref bh4-19 fc Group Trowbridge_A
28	19:22:52	20250611-1738-B500_B.14-28	12	C13_DEPT135_Night	j40457bh	-	+	-	-	-	+	+	Ref bh4-19 fc Group Trowbridge_A
28	19:08:20	20250611-1738-B500_B.14-28	11	C13_CPD_Night256	j40457bh	-	+	-	-	-	+	+	Ref bh4-19 fc Group Trowbridge_A
28	19:01:59	20250611-1738-B500_B.14-28	10	H1_Night	j40457bh	+	+	-	+	+	+	+	Ref bh4-19 fc Group Trowbridge_A
24	18:54:23	20250611-1737-B500_B.14-24	16	F19_NoCPD_Night	j40457bh	-	+	-	-	-	+	+	Ref bh4-50 fc Group Trowbridge_A
24	18:19:08	20250611-1737-B500_B.14-24	15	H1_C13_HMBC_Night	j40457bh	+	+	-	+	+	+	+	Ref bh4-50 fc Group Trowbridge_A
19	17:59:33	20250613-1616-B500_B.14-19	11	C13_CPD_Night256	q85514th	+	+	-	+	+	+	+	Ref 60XDI-Ns Group Greaney_M
22	17:53:22	20250613-1742-B500_B.14-22	11	H1_COSY_Day	b32507dt	-	+	-	-	-	+	+	Ref n3aib4sernhtbu Group Webb_S
22	17:47:23	20250613-1742-B500_B.14-22	10	H1_Day	b32507dt	+	+	-	+	+	+	+	Ref n3aib4sernhtbu Group Webb_S
17	17:28:30	20250613-1601-B500_B.14-17	11	C13_CPD_Night256	w30344xc	+	+	-	+	+	+	+	Ref xc07p Group Keerthi_A
6	17:26:38	20250613-1708-B500_B.14-6	12	H1_ExtraWide_Day	n38871ln	-	+	-	-	-	+	+	Ref ln84 45 min Group Larrosa_I
6	17:16:18	20250613-1708-B500_B.14-6	11	H1quant_Day	n38871ln	-	+	-	-	-	+	+	Ref ln84 45 min Group Larrosa_I
6	17:10:36	20250613-1708-B500_B.14-6	10	H1_Day	n38871ln	+	+	-	+	+	+	+	Ref ln84 45 min Group Larrosa_I
5	17:04:16	20250613-1647-B500_B.14-5	10	H1_Day	m10213pw	+	+	-	+	+	+	+	Ref SJW-PY2.3 Group Webb_S
53	17:03:17	20250613-1602-B500_B.14-52	20	H1_Day	y59240mb	x	-	-	-	-	-	-	Ref 50 microlit oegma in 650 microlit chloroform Group McDonald_T 50 microlit oegma in 650 microlit chloroform	Sample Changer: Error: SKIP_SAMPLE :: Error: No sample in position 53
52	16:57:17	20250613-1602-B500_B.14-52	10	H1_Day	y59240mb	+	+	-	+	+	+	+	Ref 50 microlit me02ma in 650 microlit chloroform Group McDonald_T 50 microlit me02ma in 650 microlit chloroform
27	16:51:12	20250613-1619-B500_B.14-27	10	H1_Day	q85514th	+	+	-	+	+	+	+	Ref 130XDI-Ns Group Greaney_M
26	16:45:55	20250613-1618-B500_B.14-26	10	H1_Day	q85514th	+	+	-	+	+	+	+	Ref 400XDI-Ns Group Greaney_M
25	16:40:03	20250613-1617-B500_B.14-25	10	H1_Day	q85514th	+	+	-	+	+	+	+	Ref 400XDI-P Group Greaney_M
21	16:34:25	20250613-1616-B500_B.14-21	10	H1_Day	q85514th	+	+	-	+	+	+	+	Ref 170XDI-Ns Group Greaney_M
20	16:28:50	20250613-1616-B500_B.14-20	10	H1_Day	q85514th	+	+	-	+	+	+	+	Ref 170XDI-P Group Greaney_M
19	16:22:45	20250613-1616-B500_B.14-19	10	H1_Day	q85514th	+	+	-	+	+	+	+	Ref 60XDI-Ns Group Greaney_M
17	16:17:02	20250613-1601-B500_B.14-17	10	H1_Day	w30344xc	+	+	-	+	+	+	+	Ref xc07p Group Keerthi_A
16	16:11:00	20250613-1601-B500_B.14-16	10	H1_Day	w30344xc	+	+	-	+	+	+	+	Ref xc06r Group Keerthi_A
11	15:53:18	20250613-1137-B500_B.14-11	11	C13_CPD_Night256	z86427mk	+	+	-	+	+	+	+	Ref MK-156 Group Procter_D
10	15:35:05	20250613-1137-B500_B.14-10	11	C13_CPD_Night256	z86427mk	+	+	-	+	+	+	+	Ref MK-095 Group Procter_D
8	15:16:55	20250613-1136-B500_B.14-8	12	C13_CPD_Night256	z86427mk	+	+	-	+	+	+	+	Ref MK-103 Group Procter_D
7	14:58:07	20250613-1135-B500_B.14-7	12	C13_CPD_Night256	z86427mk	+	+	-	+	+	+	+	Ref MK-164 Group Procter_D
13	14:52:22	20250613-1440-B500_B.14-13	10	H1_Day	m10213pw	+	+	-	+	+	+	+	Ref SJW-PY2.2 Group Webb_S
6	14:33:32	20250613-1135-B500_B.14-6	12	C13_CPD_Night256	z86427mk	+	+	-	+	+	+	+	Ref MK-140 Group Procter_D
15	14:26:22	20250613-1410-B500_B.14-15	10	H1_Day	m90460ad	+	+	-	+	+	+	+	Ref mfg-ad-380e Group Greaney_M
14	14:20:10	20250613-1410-B500_B.14-14	10	H1_Day	m90460ad	+	+	-	+	+	+	+	Ref mfg-ad-380d Group Greaney_M
13	14:14:00	20250613-1332-B500_B.14-13	11	H1_COSY_Day	m10213pw	-	+	-	-	-	+	+	Ref SJW-PY2.1 Group Webb_S
13	14:07:46	20250613-1332-B500_B.14-13	10	H1_Day	m10213pw	+	+	-	+	+	+	+	Ref SJW-PY2.1 Group Webb_S
38	14:02:00	20250613-1314-B500_B.14-38	10	H1_Day	y58410zl	+	+	-	+	+	+	+	Ref St/ACVA/HCO2K-3h Group MIG
37	13:56:18	20250613-1313-B500_B.14-37	10	H1_Day	y58410zl	+	+	-	+	+	+	+	Ref St/ACVA/HCO2K-2h25 Group MIG
36	13:50:36	20250613-1312-B500_B.14-36	10	H1_Day	y58410zl	+	+	-	+	+	+	+	Ref St/ACVA/HCO2K-1h40 Group MIG
35	13:44:53	20250613-1311-B500_B.14-35	10	H1_Day	y58410zl	+	+	-	+	+	+	+	Ref St/ACVA/HCO2K-12min Group MIG
34	13:38:53	20250613-1310-B500_B.14-34	10	H1_Day	y58410zl	+	+	-	+	+	+	+	Ref St/ACVA/HCO2K-0h Group MIG
33	13:32:42	20250613-1309-B500_B.14-33	10	H1_Day	y58410zl	+	+	-	+	+	+	+	Ref St/ACVA-3h Group MIG
32	13:27:26	20250613-1307-B500_B.14-32	10	H1_Day	y58410zl	+	+	-	+	+	+	+	Ref St/ACVA-1h40 Group MIG
31	13:21:18	20250613-1304-B500_B.14-31	10	H1_Day	y58410zl	+	+	-	+	+	+	+	Ref St/ACVA-12min Group MIG
21	13:05:35	20250613-1213-B500_B.14-21	10	H1quant_Day	q80578pk	+	+	-	+	+	+	+	Ref MJJ-PK-01-006-903024 Group Other
20	12:59:36	20250613-1212-B500_B.14-20	10	H1_Day	q80578pk	+	+	-	+	+	+	+	Ref MJJ-PK-01-006-1305024-solid Group Other
11	12:54:04	20250613-1137-B500_B.14-11	10	H1_Day	z86427mk	+	+	-	+	+	+	+	Ref MK-156 Group Procter_D
10	12:48:01	20250613-1137-B500_B.14-10	10	H1_Day	z86427mk	+	+	-	+	+	+	+	Ref MK-095 Group Procter_D
8	12:46:09	20250613-1136-B500_B.14-8	11	F19_NoCPD_Day	z86427mk	-	+	-	-	-	+	+	Ref MK-103 Group Procter_D
8	12:40:05	20250613-1136-B500_B.14-8	10	H1_Day	z86427mk	+	+	-	+	+	+	+	Ref MK-103 Group Procter_D
7	12:38:13	20250613-1135-B500_B.14-7	11	F19_NoCPD_Day	z86427mk	-	+	-	-	-	+	+	Ref MK-164 Group Procter_D
7	12:32:34	20250613-1135-B500_B.14-7	10	H1_Day	z86427mk	+	+	-	+	+	+	+	Ref MK-164 Group Procter_D
6	12:30:01	20250613-1135-B500_B.14-6	11	F19_NoCPD_Day	z86427mk	-	+	-	-	-	+	+	Ref MK-140 Group Procter_D
6	12:24:24	20250613-1135-B500_B.14-6	10	H1_Day	z86427mk	+	+	-	+	+	+	+	Ref MK-140 Group Procter_D
5	12:08:30	20250613-1105-B500_B.14-5	10	H1quant_Day	q80578pk	+	+	-	+	+	+	+	Ref MJJ-PK-01-006-903016 Group Other
4	11:53:08	20250613-1105-B500_B.14-4	10	H1quant_Day	q80578pk	+	+	-	+	+	+	+	Ref MJJ-PK-01-006-1305324L Group Other
3	11:38:20	20250613-1105-B500_B.14-3	10	H1quant_Day	q80578pk	+	+	-	+	+	+	+	Ref MJJ-PK-01-006-905324 Group Other
2	11:23:37	20250613-1104-B500_B.14-2	10	H1quant_Day	q80578pk	+	+	-	+	+	+	+	Ref MJJ-PK-01-006-905016 Group Other
1	11:06:38	20250613-1103-B500_B.14-1	10	H1quant_Day	q80578pk	+	+	-	+	+	+	+	Ref MJJ-PK-01-006-control Group Other
32	10:14:34	20250613-0959-B500_B.14-32	10	H1_Day	h55599rb	+	+	-	+	+	+	+	Ref RB-9-PXTOMe Group Procter_D
31	10:08:20	20250613-0958-B500_B.14-31	10	H1_Day	y38246dt	+	+	-	+	+	+	+	Ref GDB-DT-911-21h Group DeBo_G GDB-DT-911-21h
26	09:53:47	20250612-1643-B500_B.14-26	11	C13_CPD_Night256	zzradcliffej	-	+	-	-	-	+	+	Ref JRSI-431-37 Group External
26	09:47:27	20250612-1643-B500_B.14-26	10	H1_Night	zzradcliffej	+	+	-	+	+	+	+	Ref JRSI-431-37 Group External
11	09:41:06	20250613-0940-B500_B.14-11	10	H1_Day	p69174hv	+	+	-	+	+	+	+	Ref GC-HV Cy 14 Crude Group Crisenza_G
24	08:14:30	20250611-1737-B500_B.14-24	14	H1_C13_HSQC_Night	j40457bh	-	+	-	-	-	+	+	Ref bh4-50 fc Group Trowbridge_A
24	07:32:35	20250611-1737-B500_B.14-24	13	H1_COSY_HiRes_Night	j40457bh	-	+	-	-	-	+	+	Ref bh4-50 fc Group Trowbridge_A
24	07:04:46	20250611-1737-B500_B.14-24	12	C13_DEPT135_Night	j40457bh	-	+	-	-	-	+	+	Ref bh4-50 fc Group Trowbridge_A
24	06:50:14	20250611-1737-B500_B.14-24	11	C13_CPD_Night256	j40457bh	-	+	-	-	-	+	+	Ref bh4-50 fc Group Trowbridge_A
24	06:44:07	20250611-1737-B500_B.14-24	10	H1_Night	j40457bh	+	+	-	+	+	+	+	Ref bh4-50 fc Group Trowbridge_A
23	06:37:18	20250611-1736-B500_B.14-23	16	F19_NoCPD_Night	j40457bh	-	+	-	-	-	+	+	Ref bh3-161 fc Group Trowbridge_A
23	06:05:48	20250611-1736-B500_B.14-23	15	H1_C13_HMBC_Night	j40457bh	-	+	-	-	-	+	+	Ref bh3-161 fc Group Trowbridge_A
23	05:44:16	20250611-1736-B500_B.14-23	14	H1_C13_HSQC_Night	j40457bh	-	+	-	-	-	+	+	Ref bh3-161 fc Group Trowbridge_A
23	05:02:18	20250611-1736-B500_B.14-23	13	H1_COSY_HiRes_Night	j40457bh	-	+	-	-	-	+	+	Ref bh3-161 fc Group Trowbridge_A
23	04:34:52	20250611-1736-B500_B.14-23	12	C13_DEPT135_Night	j40457bh	-	+	-	-	-	+	+	Ref bh3-161 fc Group Trowbridge_A
23	04:20:24	20250611-1736-B500_B.14-23	11	C13_CPD_Night256	j40457bh	-	+	-	-	-	+	+	Ref bh3-161 fc Group Trowbridge_A
23	04:14:51	20250611-1736-B500_B.14-23	10	H1_Night	j40457bh	+	+	-	+	+	+	+	Ref bh3-161 fc Group Trowbridge_A
22	03:43:17	20250611-1736-B500_B.14-22	15	H1_C13_HMBC_Night	j40457bh	-	+	-	-	-	+	+	Ref bh4-114 fc Group Trowbridge_A
22	03:21:47	20250611-1736-B500_B.14-22	14	H1_C13_HSQC_Night	j40457bh	-	+	-	-	-	+	+	Ref bh4-114 fc Group Trowbridge_A
22	02:39:47	20250611-1736-B500_B.14-22	13	H1_COSY_HiRes_Night	j40457bh	-	+	-	-	-	+	+	Ref bh4-114 fc Group Trowbridge_A
22	02:12:20	20250611-1736-B500_B.14-22	12	C13_DEPT135_Night	j40457bh	-	+	-	-	-	+	+	Ref bh4-114 fc Group Trowbridge_A
22	01:57:19	20250611-1736-B500_B.14-22	11	C13_CPD_Night256	j40457bh	-	+	-	-	-	+	+	Ref bh4-114 fc Group Trowbridge_A
22	01:51:09	20250611-1736-B500_B.14-22	10	H1_Night	j40457bh	+	+	-	+	+	+	+	Ref bh4-114 fc Group Trowbridge_A
37	01:29:39	20250611-1556-B500_B.14-37	13	H1_C13_HSQC_Night	q17816aj	-	+	-	-	-	+	+	Ref IR-AJ-015a(2) Group Riddell_I
37	01:25:22	20250611-1556-B500_B.14-37	12	H1_ExtraWide_Night	q17816aj	-	+	-	-	-	+	+	Ref IR-AJ-015a(2) Group Riddell_I
37	01:10:56	20250611-1556-B500_B.14-37	11	C13_CPD_Night256	q17816aj	-	+	-	-	-	+	+	Ref IR-AJ-015a(2) Group Riddell_I
37	01:05:20	20250611-1556-B500_B.14-37	10	H1_Night	q17816aj	+	+	-	+	+	+	+	Ref IR-AJ-015a(2) Group Riddell_I
36	00:43:44	20250611-1556-B500_B.14-36	13	H1_C13_HSQC_Night	q17816aj	-	+	-	-	-	+	+	Ref IR-AJ-015(Zn_2) Group Riddell_I
36	00:39:29	20250611-1556-B500_B.14-36	12	H1_ExtraWide_Night	q17816aj	-	+	-	-	-	+	+	Ref IR-AJ-015(Zn_2) Group Riddell_I
36	00:24:58	20250611-1556-B500_B.14-36	11	C13_CPD_Night256	q17816aj	-	+	-	-	-	+	+	Ref IR-AJ-015(Zn_2) Group Riddell_I
36	00:18:38	20250611-1556-B500_B.14-36	10	H1_Night	q17816aj	+	+	-	+	+	+	+	Ref IR-AJ-015(Zn_2) Group Riddell_I
35	23:57:06	20250611-1555-B500_B.14-35	13	H1_C13_HSQC_Night	q17816aj	-	+	-	-	-	+	+	Ref IR-AJ-015(4) Group Riddell_I
35	23:52:50	20250611-1555-B500_B.14-35	12	H1_ExtraWide_Night	q17816aj	-	+	-	-	-	+	+	Ref IR-AJ-015(4) Group Riddell_I
35	23:38:16	20250611-1555-B500_B.14-35	11	C13_CPD_Night256	q17816aj	-	+	-	-	-	+	+	Ref IR-AJ-015(4) Group Riddell_I
35	23:32:27	20250611-1555-B500_B.14-35	10	H1_Night	q17816aj	+	+	-	+	x	+	+	Ref IR-AJ-015(4) Group Riddell_I
52	23:00:55	20250611-1452-B500_B.14-52	15	H1_C13_HMBC_Night	m52750pm	-	+	-	-	-	+	+	Ref GCPM52F2Pchar Group Crisenza_G
52	22:38:45	20250611-1452-B500_B.14-52	14	H1_C13_HSQC_Night	m52750pm	-	+	-	-	-	+	+	Ref GCPM52F2Pchar Group Crisenza_G
52	21:52:15	20250611-1452-B500_B.14-52	13	H1_COSY_HiRes_Night	m52750pm	+	+	-	+	+	+	+	Ref GCPM52F2Pchar Group Crisenza_G
60	21:24:42	20250612-1559-B500_B.14-60	13	mSELNOGPZS	service	-	+	-	-	-	+	+	Ref IC610-01 Group service 4.36ppm
60	20:57:02	20250612-1559-B500_B.14-60	12	mSELNOGPZS	service	-	+	-	-	-	+	+	Ref IC610-01 Group service 4.48ppm
60	20:26:00	20250612-1559-B500_B.14-60	11	mSELNOGPZS	service	+	+	-	+	+	+	+	Ref IC610-01 Group service 4.83ppm
59	19:58:31	20250612-1522-B500_B.14-59	13	mSELNOGPZS	service	-	+	-	-	-	+	+	Ref IC609-1 Group Service 4.25ppm
59	19:31:06	20250612-1522-B500_B.14-59	12	mSELNOGPZS	service	-	+	-	-	-	+	+	Ref IC609-1 Group Service 4.40ppm
59	19:00:10	20250612-1522-B500_B.14-59	11	mSELNOGPZS	service	+	+	-	+	+	+	+	Ref IC609-1 Group Service 4.76ppm
15	18:18:18	20250612-1740-B500_B.14-15	12	H1_COSY_HiRes_Night	z40973rs	-	+	-	-	-	+	+	Ref gdb-rs-71-MeOH wash Acetone Group DeBo_G
15	18:07:40	20250612-1740-B500_B.14-15	11	H1_Night128	z40973rs	-	+	-	-	-	+	+	Ref gdb-rs-71-MeOH wash Acetone Group DeBo_G
15	18:02:01	20250612-1740-B500_B.14-15	10	H1_Day	z40973rs	+	+	-	+	+	+	+	Ref gdb-rs-71-MeOH wash Acetone Group DeBo_G
14	17:59:04	20250612-1727-B500_B.14-14	11	C13_CPD_Day	q49270na	-	+	-	-	-	+	+	Ref na-36 Group Greaney_M
14	17:53:53	20250612-1727-B500_B.14-14	10	H1_Day	q49270na	+	+	-	+	+	+	+	Ref na-36 Group Greaney_M
13	17:48:41	20250612-1735-B500_B.14-13	10	H1_Day	z88883sp	+	+	-	+	+	+	+	Ref XG06a Group Romanov_A Microwave 250 C 4 hours
12	17:45:45	20250612-1727-B500_B.14-12	11	C13_CPD_Day	q49270na	-	+	-	-	-	+	+	Ref na-35 Group Greaney_M
12	17:39:26	20250612-1727-B500_B.14-12	10	H1_Day	q49270na	+	+	-	+	+	+	+	Ref na-35 Group Greaney_M
10	17:36:30	20250612-1725-B500_B.14-10	11	C13_CPD_Day	q49270na	-	+	-	-	-	+	+	Ref na-34 Group Greaney_M
10	17:30:57	20250612-1725-B500_B.14-10	10	H1_Day	q49270na	+	+	-	+	+	+	+	Ref na-34 Group Greaney_M
3	17:13:05	20250612-1422-B500_B.14-3	11	C13_CPD_Night256	w30344xc	+	+	-	+	+	+	+	Ref XC06 Group Keerthi_A
2	16:54:04	20250612-1421-B500_B.14-2	11	C13_CPD_Night256	w30344xc	+	+	-	+	+	+	+	Ref xc04 Group Keerthi_A
38	16:52:02	20250612-1611-B500_B.14-38	12	F19_NoCPD_Day	v97511sv	-	+	-	-	-	+	+	Ref DPM-SV-53 1 day Group Mills_D [Ph3C][BArF24] + La(Cpttt)2(BH4) 1 day
38	16:47:16	20250612-1611-B500_B.14-38	11	C13_DEPTQ_Day	v97511sv	-	+	-	-	-	+	+	Ref DPM-SV-53 1 day Group Mills_D [Ph3C][BArF24] + La(Cpttt)2(BH4) 1 day
38	16:41:21	20250612-1611-B500_B.14-38	10	H1_Day	v97511sv	+	+	-	+	x	+	+	Ref DPM-SV-53 1 day Group Mills_D [Ph3C][BArF24] + La(Cpttt)2(BH4) 1 day
8	16:35:14	20250612-1620-B500_B.14-8	10	H1_Day	m90460ad	+	+	-	+	+	+	+	Ref mfg-ad-389c Group Greaney_M
7	16:30:20	20250612-1620-B500_B.14-7	10	H1_Day	m90460ad	+	+	-	+	x	+	+	Ref mfg-ad-389b Group Greaney_M
6	16:23:37	20250612-1620-B500_B.14-6	10	H1_Day	m90460ad	+	+	-	+	+	+	+	Ref mfg-ad-389a Group Greaney_M
5	16:17:31	20250612-1543-B500_B.14-5	11	H1_COSY_Day	m10213pw	-	+	-	-	-	+	+	Ref SJW-PY2 Group Webb_S
5	16:10:27	20250612-1543-B500_B.14-5	10	H1_Day	m10213pw	+	+	-	+	+	+	+	Ref SJW-PY2 Group Webb_S
60	16:02:58	20250612-1559-B500_B.14-60	10	mPROTONscout	service	+	+	-	+	+	+	+	Ref IC610-01 Group service
4	15:57:01	20250612-1540-B500_B.14-4	10	H1_Day	m14269jw	+	+	-	+	+	+	+	Ref IR-JW-3060 Group Riddell_I
59	15:47:20	20250612-1522-B500_B.14-59	10	mPROTONscout	service	+	+	-	+	+	+	+	Ref IC609-1 Group Service
2	15:36:42	20250612-1421-B500_B.14-2	11	C13_CPD_Night256	w30344xc	+	+	-	+	+	-	-	Ref xc04 Group Keerthi_A	Automation was stopped by user
59	15:35:26	20250612-1522-B500_B.14-59	10	mPROTONscout	service	-	+	-	-	-	-	-	Ref IC609-1 Group Service 4.76ppm	Automation was stopped by user
59	15:25:25	20250612-1522-B500_B.14-59	10	mPROTONscout	service	+	+	-	+	+	-	-	Ref IC609-1 Group Service 4.76ppm	Automation was stopped by user
1	15:07:50	20250612-1419-B500_B.14-1	11	C13_CPD_Night256	w30344xc	+	+	-	+	+	+	+	Ref XC03 Group Keerthi_A
1	15:03:36	20250612-1419-B500_B.14-1	11	C13_CPD_Night256	w30344xc	+	-	-	-	-	-	-	Ref XC03 Group Keerthi_A	Automation was stopped by user
9	14:59:41	20250612-1449-B500_B.14-9	12	C13_CPD_Day	z86427mk	-	+	-	-	-	+	+	Ref MK-180 F14-18 Group Procter_D
9	14:57:48	20250612-1449-B500_B.14-9	11	F19_NoCPD_Day	z86427mk	-	+	-	-	-	+	+	Ref MK-180 F14-18 Group Procter_D
9	14:52:10	20250612-1449-B500_B.14-9	10	H1_Day	z86427mk	+	+	-	+	+	+	+	Ref MK-180 F14-18 Group Procter_D
7	14:46:10	20250612-1442-B500_B.14-7	10	H1_Day	service	+	+	-	+	+	+	+	Ref PCL test Group service
4	14:40:09	20250612-1424-B500_B.14-4	10	H1_Day	m09677nb	+	+	-	+	+	+	+	Ref py ome Group Greaney_M
3	14:34:28	20250612-1422-B500_B.14-3	10	H1_Day	w30344xc	+	+	-	+	+	+	+	Ref XC06 Group Keerthi_A
2	14:28:35	20250612-1421-B500_B.14-2	10	H1_Day	w30344xc	+	+	-	+	+	+	+	Ref xc04 Group Keerthi_A
1	14:21:23	20250612-1419-B500_B.14-1	10	H1_Day	w30344xc	+	+	-	+	+	+	+	Ref XC03 Group Keerthi_A
14	14:04:26	20250612-1358-B500_B.14-14	11	C13_CPD_Day	p37941hb	-	+	-	-	-	+	+	Ref HB-250612-02 5mM AQ 16m LiTFSI pH 7.5 Group Dryfe_R CDCl3 ext ref
14	13:59:29	20250612-1358-B500_B.14-14	10	H1_Day	p37941hb	+	+	-	+	+	+	+	Ref HB-250612-02 5mM AQ 16m LiTFSI pH 7.5 Group Dryfe_R CDCl3 ext ref
49	11:02:24	20250612-1057-B500_B.14-49	10	H1_Day	z40973rs	+	+	-	+	+	+	+	Ref gdb-rs-97 wash Group DeBo_G
46	11:00:20	20250612-1053-B500_B.14-46	11	H1_Day	b32507dt	-	+	-	-	-	+	+	Ref dtgb12 Group Webb_S
46	10:53:57	20250612-1053-B500_B.14-46	10	C13_CPD_Day	b32507dt	+	+	-	+	+	+	+	Ref dtgb12 Group Webb_S
40	09:16:01	20250612-0915-B500_B.14-40	10	H1_Day	h55599rb	+	+	-	+	+	+	+	Ref RB-9-529.2B Group Procter_D
50	09:07:44	20250612-0015-B500_B.14-49	20	H1_Night	m09677nb	+	+	-	+	+	+	+	Ref py amide 2 Group Greaney_M
49	09:01:32	20250612-0015-B500_B.14-49	10	H1_Night	m09677nb	+	+	-	+	+	+	+	Ref py amide 1 Group Greaney_M
48	08:55:42	20250612-0014-B500_B.14-48	10	H1_Night	m09677nb	+	+	-	+	+	+	+	Ref py OMe Group Greaney_M
11	08:40:44	20250608-1933-B500_B.14-11	16	H1_Night128	e04286tn	+	+	-	+	+	+	+	Ref GDB-TNG-III-490 Group DeBo_G
13	08:34:39	20250611-1622-B500_B.14-13	11	H1_COSY_Day	z40973rs	-	+	-	-	-	+	+	Ref gdb-rs-96 crude Group DeBo_G
13	08:29:05	20250611-1622-B500_B.14-13	10	H1_Day	z40973rs	+	+	-	+	+	+	+	Ref gdb-rs-96 crude Group DeBo_G
52	08:01:33	20250611-1452-B500_B.14-52	12	C13_DEPT135_Night	m52750pm	-	+	-	-	-	+	+	Ref GCPM52F2Pchar Group Crisenza_G
52	07:47:07	20250611-1452-B500_B.14-52	11	C13_CPD_Night256	m52750pm	-	+	-	-	-	+	+	Ref GCPM52F2Pchar Group Crisenza_G
52	07:40:19	20250611-1452-B500_B.14-52	10	H1_Night	m52750pm	+	+	-	+	+	+	+	Ref GCPM52F2Pchar Group Crisenza_G
47	07:20:41	20250611-1450-B500_B.14-47	11	C13_CPD_Night256	w12998gm	+	+	-	+	+	+	+	Ref il-gm-8-066-conc Group Larrosa_I
12	06:09:43	20250611-1447-B500_B.14-12	10	H1_1024_Night	y37570lc	+	+	-	+	+	+	+	Ref lc612-1 MeOH E1151 Group DeBo_G
10	04:58:53	20250611-1446-B500_B.14-10	10	H1_1024_Night	y37570lc	+	+	-	+	+	+	+	Ref lc612-1 polymer E1151 Group DeBo_G
9	03:47:57	20250611-1446-B500_B.14-9	10	H1_1024_Night	y37570lc	+	+	-	+	+	+	+	Ref lc612-1 MeOH E1150 Group DeBo_G
8	02:35:58	20250611-1446-B500_B.14-8	10	H1_1024_Night	y37570lc	+	+	-	+	+	+	+	Ref lc612-1 polymer E1150 Group DeBo_G
45	02:04:24	20250611-1442-B500_B.14-45	15	H1_C13_HMBC_Night	m52750pm	-	+	-	-	-	+	+	Ref GCPM45PCHAR-2 Group Crisenza_G
45	01:41:37	20250611-1442-B500_B.14-45	14	H1_C13_HSQC_Night	m52750pm	-	+	-	-	-	+	+	Ref GCPM45PCHAR-2 Group Crisenza_G
45	00:59:47	20250611-1442-B500_B.14-45	13	H1_COSY_HiRes_Night	m52750pm	-	+	-	-	-	+	+	Ref GCPM45PCHAR-2 Group Crisenza_G
45	00:32:20	20250611-1442-B500_B.14-45	12	C13_DEPT135_Night	m52750pm	-	+	-	-	-	+	+	Ref GCPM45PCHAR-2 Group Crisenza_G
45	00:17:54	20250611-1442-B500_B.14-45	11	C13_CPD_Night256	m52750pm	-	+	-	-	-	+	+	Ref GCPM45PCHAR-2 Group Crisenza_G
45	00:12:45	20250611-1442-B500_B.14-45	10	H1_Night	m52750pm	+	+	-	+	+	+	+	Ref GCPM45PCHAR-2 Group Crisenza_G
21	23:41:45	20250611-1151-B500_B.14-21	12	H1_C13_HMBC_US_Night	b32507dt	-	+	-	-	-	+	+	Ref DTZSERNHTBU Group Webb_S
21	23:20:11	20250611-1151-B500_B.14-21	11	H1_C13_HSQC_Night	b32507dt	-	+	-	-	-	+	+	Ref DTZSERNHTBU Group Webb_S
21	23:12:42	20250611-1151-B500_B.14-21	10	H1_Night	b32507dt	+	+	-	+	+	+	+	Ref DTZSERNHTBU Group Webb_S
20	22:41:52	20250611-1150-B500_B.14-20	12	H1_C13_HMBC_US_Night	b32507dt	-	+	-	-	-	+	+	Ref DTHN2SERNHTBU Group Webb_S
20	22:20:20	20250611-1150-B500_B.14-20	11	H1_C13_HSQC_Night	b32507dt	-	+	-	-	-	+	+	Ref DTHN2SERNHTBU Group Webb_S
20	22:14:33	20250611-1150-B500_B.14-20	10	H1_Night	b32507dt	+	+	-	+	+	+	+	Ref DTH2NSETNHTBU Group Webb_S
56	21:43:39	20250611-1149-B500_B.14-56	12	H1_C13_HMBC_US_Night	b32507dt	-	+	-	-	-	+	+	Ref LINKER2 Group Webb_S
56	21:21:57	20250611-1149-B500_B.14-56	11	H1_C13_HSQC_Night	b32507dt	-	+	-	-	-	+	+	Ref LINKER2 Group Webb_S
56	21:14:52	20250611-1149-B500_B.14-56	10	H1_Night	b32507dt	+	+	-	+	+	+	+	Ref LINKER2 Group Webb_S
17	20:50:41	20250611-0819-B500_B.14-17	16	H1_NOESY_Night	mbdxkrn2	-	+	-	-	-	+	+	Ref GDB-RN1536 Full Char - Acetone-d6 Group DeBo_G
17	20:43:07	20250611-0819-B500_B.14-17	15	F19_NoCPD_Night	mbdxkrn2	-	+	-	-	-	+	+	Ref GDB-RN1536 Full Char - Acetone-d6 Group DeBo_G
17	20:01:18	20250611-0819-B500_B.14-17	14	H1_COSY_HiRes_Night	mbdxkrn2	-	+	-	-	-	+	+	Ref GDB-RN1536 Full Char - Acetone-d6 Group DeBo_G
17	19:39:49	20250611-0819-B500_B.14-17	13	H1_C13_HSQC_Night	mbdxkrn2	-	+	-	-	-	+	+	Ref GDB-RN1536 Full Char - Acetone-d6 Group DeBo_G
17	19:08:20	20250611-0819-B500_B.14-17	12	H1_C13_HMBC_Night	mbdxkrn2	-	+	-	-	-	+	+	Ref GDB-RN1536 Full Char - Acetone-d6 Group DeBo_G
17	19:06:10	20250611-0819-B500_B.14-17	11	H1_Night	mbdxkrn2	-	+	-	-	-	+	+	Ref GDB-RN1536 Full Char - Acetone-d6 Group DeBo_G
17	18:07:44	20250611-0819-B500_B.14-17	10	C13_CPD_Night256	mbdxkrn2	+	+	-	+	x	+	+	Ref GDB-RN1536 Full Char - Acetone-d6 Group DeBo_G
7	18:02:23	20250611-1649-B500_B.14-7	10	H1_Day	z86427mk	+	+	-	+	+	+	+	Ref MK-180 F18 Group Procter_D
6	17:57:10	20250611-1648-B500_B.14-6	10	H1_Day	z86427mk	+	+	-	+	+	+	+	Ref MK-180 F14 Group Procter_D
5	17:54:05	20250610-2145-B500_B.14-4	22	C13_CPD_Day	q49270na	-	+	-	-	-	+	+	Ref 33 Group Greaney_M
5	17:47:54	20250610-2145-B500_B.14-4	21	H1_Day	q49270na	+	+	-	+	+	+	+	Ref 33 Group Greaney_M
4	17:32:33	20250611-1621-B500_B.14-4	10	H1quant_Day	q80578pk	+	+	-	+	+	+	+	Ref MJJ-PK-01-006-1305124 Group Other
3	17:17:04	20250611-1621-B500_B.14-3	10	H1quant_Day	q80578pk	+	+	-	+	+	+	+	Ref MJJ-PK-01-006-1305024 Group Other
2	17:01:56	20250611-1620-B500_B.14-2	10	H1quant_Day	q80578pk	+	+	-	+	+	+	+	Ref MJJ-PK-01-006-1303524 Group Other
1	16:46:46	20250611-1619-B500_B.14-1	10	H1quant_Day	q80578pk	+	+	-	+	+	+	+	Ref MJJ-PK-01-006-1303124 Group Other
13	16:30:58	20250611-1622-B500_B.14-13	10	H1quant_Day	q80578pk	+	+	-	+	+	+	+	Ref MJJ-PK-01-006-1305324 Group Other
7	16:25:19	20250611-1435-B500_B.14-7	10	H1_Day	p69174hv	+	+	-	+	+	+	+	Ref GC-HV RO9 Flush Group Crisenza_G
6	16:18:33	20250611-1434-B500_B.14-6	10	H1_Day	p69174hv	+	+	-	+	+	+	+	Ref GC-HV RO9 P4 Group Crisenza_G
57	16:12:29	20250611-1453-B500_B.14-57	10	H1_Day	m52750pm	+	+	-	+	+	+	+	Ref GCPM56cru-1 Group Crisenza_G
55	16:05:05	20250611-1443-B500_B.14-55	10	H1_Day	m52750pm	+	+	-	+	+	+	+	Ref GCPM55cru Group Crisenza_G
51	15:57:30	20250611-1518-B500_B.14-51	10	H1_Day	p87239xt	+	+	-	+	+	+	+	Ref NL-XYT-MeOD Group Natrajan_L
50	15:51:08	20250611-1549-B500_B.14-50	10	H1_Day	y38246dt	+	+	-	+	+	+	+	Ref GDB-DT-909-104 Group DeBo_G GDB-DT-909-104
49	15:45:02	20250611-1536-B500_B.14-49	10	H1_Day	c46714th	+	+	-	+	+	+	+	Ref TH-540-002-crude Group James_M
48	15:38:33	20250611-1457-B500_B.14-48	10	H1_Day	n31353oc	+	+	-	+	+	+	+	Ref djp-oc-673 Group Procter_D
47	15:32:42	20250611-1450-B500_B.14-47	10	H1_Day	w12998gm	+	+	-	+	+	+	+	Ref il-gm-8-066-conc Group Larrosa_I
46	15:30:33	20250611-1449-B500_B.14-46	11	F19_NoCPD_Day	z86427mk	-	+	-	-	-	+	+	Ref MK-180 F15-17 Group Procter_D
46	15:25:07	20250611-1449-B500_B.14-46	10	H1_Day	z86427mk	+	+	-	+	+	+	+	Ref MK-180 F15-17 Group Procter_D
44	15:11:28	20250611-1448-B500_B.14-44	10	H1quant_Day	n38871ln	+	+	-	+	+	+	+	Ref ln83-2 8h Group Larrosa_I
43	15:09:37	20250611-1447-B500_B.14-43	11	H1_ExtraWide_Day	n38871ln	-	+	-	-	-	+	+	Ref ln83-1 4 h Group Larrosa_I
43	14:54:44	20250611-1447-B500_B.14-43	10	H1quant_Day	n38871ln	+	+	-	+	+	+	+	Ref ln83-1 4 h Group Larrosa_I
42	14:46:47	20250611-1429-B500_B.14-42	10	H1_Day	p87239xt	+	+	-	+	+	+	+	Ref NL-XYT-MeOD Group Natrajan_L
25	14:40:51	20250611-1436-B500_B.14-25	10	H1_Day	y38246dt	+	+	-	+	+	+	+	Ref GDB-DT-909-64-80 Group DeBo_G GDB-DT-909-64-80
24	14:37:55	20250611-1425-B500_B.14-24	11	C13_CPD_Day	f14199vs	-	+	-	-	-	+	+	Ref vs262-n1 Group Keerthi_A
24	14:31:02	20250611-1425-B500_B.14-24	10	H1_Day	f14199vs	+	+	-	+	+	+	+	Ref vs262-n1 Group Keerthi_A
23	14:25:32	20250611-1415-B500_B.14-23	10	H1_Day	j39602jx	+	+	-	+	+	+	+	Ref Test before purification Group Other
22	14:19:50	20250611-1408-B500_B.14-22	10	H1_Day	h55599rb	+	+	-	+	+	+	+	Ref RB-SM Group Procter_D
19	14:14:20	20250611-1407-B500_B.14-19	10	H1_Day	h55599rb	+	+	-	+	+	+	+	Ref RB-9-535B Group Procter_D
18	14:08:18	20250611-1407-B500_B.14-18	10	H1_Day	h55599rb	+	+	-	+	+	+	+	Ref RB-9-535A Group Procter_D
15	14:01:19	20250611-1400-B500_B.14-15	10	H1_Wide_Day	q80578pk	+	+	-	+	+	+	+	Ref MJJ-PK-01-003 Group Other
50	13:42:23	20250611-1128-B500_B.14-50	10	H1quant_Day	q80578pk	+	+	-	+	+	+	+	Ref MJJ-PK-01-006-1305316L Group Other
48	13:37:10	20250611-1328-B500_B.14-48	10	H1_Day	d47555aa	+	+	-	+	+	+	+	Ref DJP-ASA-1154 F24-26 Group Procter_D
47	13:31:54	20250611-1241-B500_B.14-47	10	H1_Day	w30344xc	+	+	-	+	+	+	+	Ref XC04 Group Keerthi_A
46	13:25:33	20250611-1225-B500_B.14-45	20	C13_CPD_Day	m09677nb	+	+	-	+	+	+	+	Ref thiophene Group Greaney_M
45	13:19:14	20250611-1225-B500_B.14-45	10	C13_CPD_Day	m09677nb	+	+	-	+	+	+	+	Ref furan Group Greaney_M
44	13:13:37	20250611-1216-B500_B.14-43	20	H1_Day	b26045ab	+	+	-	+	+	+	+	Ref AT-ABO-02-345-iso Group Trowbridge_A
43	13:07:39	20250611-1216-B500_B.14-43	10	H1_Day	b26045ab	+	+	-	+	+	+	+	Ref AT-ABO-02-344-iso Group Trowbridge_A
42	13:04:41	20250611-1043-B500_B.14-42	11	C13_CPD_Day	p37941hb	-	+	-	-	-	+	+	Ref HB-250610-07 5mM AQ_16m LiTFSI_pH3 Group Dryfe_R CDCl3 as external ref
42	12:59:37	20250611-1043-B500_B.14-42	10	H1_Day	p37941hb	+	+	-	+	+	+	+	Ref HB-250610-07 5mM AQ_16m LiTFSI_pH3 Group Dryfe_R CDCl3 as external ref
41	12:57:52	20250611-1207-B500_B.14-41	11	H1_ExtraWide_Day	n38871ln	-	+	-	-	-	+	+	Ref ln83-1 2h Group Larrosa_I
41	12:43:34	20250611-1207-B500_B.14-41	10	H1quant_Day	n38871ln	+	+	-	+	+	+	+	Ref ln83-1 2h Group Larrosa_I
40	12:40:28	20250611-1206-B500_B.14-40	11	C13_CPD_Day	f14199vs	-	+	-	-	-	+	+	Ref hhtp-flurochem Group Keerthi_A
40	12:34:46	20250611-1206-B500_B.14-40	10	H1_Day	f14199vs	+	+	-	+	+	+	+	Ref hhtp-flurochem Group Keerthi_A
39	12:28:36	20250611-1204-B500_B.14-39	11	H1_COSY_Day	m10213pw	-	+	-	-	-	+	+	Ref SJW-PY2 Group Webb_S
39	12:22:45	20250611-1204-B500_B.14-39	10	H1_Day	m10213pw	+	+	-	+	+	+	+	Ref SJW-PY2 Group Webb_S
38	12:20:43	20250611-1153-B500_B.14-38	12	F19_NoCPD_Day	v97511sv	-	+	-	-	-	+	+	Ref DPM-SV-53 Group Mills_D [Ph3C][BArF24] + Ln(Cpttt)2(BH4) t = 1 hrs?
38	12:15:41	20250611-1153-B500_B.14-38	11	C13_DEPTQ_Day	v97511sv	-	+	-	-	-	+	+	Ref DPM-SV-53 Group Mills_D [Ph3C][BArF24] + Ln(Cpttt)2(BH4) t = 1 hrs?
38	12:10:28	20250611-1153-B500_B.14-38	10	H1_Day	v97511sv	+	+	-	+	x	+	+	Ref DPM-SV-53 Group Mills_D [Ph3C][BArF24] + Ln(Cpttt)2(BH4) t = 1 hrs?
37	12:03:52	20250611-1140-B500_B.14-37	10	H1_Day	p87239xt	+	+	-	+	+	+	+	Ref NL-XYT-MeOD Group Natrajan_L
36	11:58:06	20250611-1123-B500_B.14-36	10	H1_Day	r25963ar	+	+	-	+	+	+	+	Ref 35MeQuinAuCl Group Romanov_A 35MeQuinAuCl
35	11:56:08	20250611-1030-B500_B.14-35	11	F19_NoCPD_Day	w52164bc	-	+	-	-	-	+	+	Ref BC-11-005 P4 Group James_M
35	11:50:25	20250611-1030-B500_B.14-35	10	H1_Day	w52164bc	+	+	-	+	+	+	+	Ref BC-11-005 P4 Group James_M
34	11:48:25	20250611-1030-B500_B.14-34	11	F19_NoCPD_Day	w52164bc	-	+	-	-	-	+	+	Ref BC-11-004 P2 Group James_M
34	11:42:42	20250611-1030-B500_B.14-34	10	H1_Day	w52164bc	+	+	-	+	+	+	+	Ref BC-11-004 P2 Group James_M
33	11:40:57	20250611-1111-B500_B.14-33	11	H1_ExtraWide_Day	n38871ln	-	+	-	-	-	+	+	Ref ln83-1 1 h Group Larrosa_I
33	11:28:03	20250611-1111-B500_B.14-33	10	H1quant_Day	n38871ln	+	+	-	+	+	+	+	Ref ln83-1 1 h Group Larrosa_I
31	11:21:33	20250611-1102-B500_B.14-31	10	H1_Day	e02956op	+	+	-	+	+	+	+	Ref GDB-OP0289A-1H Group DeBo_G
30	11:15:03	20250611-1056-B500_B.14-30	10	H1_Day	p87239xt	+	+	-	+	+	+	+	Ref NL-XYT-MeOD Group Natrajan_L
29	11:12:59	20250611-1027-B500_B.14-29	11	F19_NoCPD_Day	w52164bc	-	+	-	-	-	+	+	Ref BC-11-003 TBD Group James_M
29	11:06:51	20250611-1027-B500_B.14-29	10	H1_Day	w52164bc	+	+	-	+	+	+	+	Ref BC-11-003 TBD Group James_M
28	11:00:21	20250611-1026-B500_B.14-28	10	H1_Day	w52164bc	+	+	-	+	+	+	+	Ref BC-08-223 P2 Group James_M
27	10:54:22	20250611-1026-B500_B.14-27	10	H1_Day	w52164bc	+	+	-	+	+	+	+	Ref BC-08-222 p-Ac 1.0 mmol Group James_M
26	10:52:22	20250611-1033-B500_B.14-26	11	H1_ExtraWide_Day	n38871ln	-	+	-	-	-	+	+	Ref ln83-1 15 min Group Larrosa_I
26	10:38:20	20250611-1033-B500_B.14-26	10	H1quant_Day	n38871ln	+	+	-	+	+	+	+	Ref ln83-1 15 min Group Larrosa_I
25	10:26:59	20250611-1021-B500_B.14-25	11	H1quant_Day	d47555aa	-	+	-	-	-	+	+	Ref DJP-ASA-1154 crude Group Procter_D
25	10:21:34	20250611-1021-B500_B.14-25	10	H1_Day	d47555aa	+	+	-	+	+	+	+	Ref DJP-ASA-1154 crude Group Procter_D
19	10:18:44	20250611-0957-B500_B.14-19	11	H1_Day	n38871ln	-	+	-	-	-	+	+	Ref ln83-1 beforte piv Group Larrosa_I
19	10:13:30	20250611-0957-B500_B.14-19	10	H1_ExtraWide_Day	n38871ln	+	+	-	+	+	+	+	Ref ln83-1 beforte piv Group Larrosa_I
18	10:11:40	20250611-0957-B500_B.14-18	11	H1_ExtraWide_Day	n38871ln	-	+	-	-	-	+	+	Ref ln83-2 overnight Group Larrosa_I
18	09:58:02	20250611-0957-B500_B.14-18	10	H1quant_Day	n38871ln	+	+	-	+	+	+	+	Ref ln83-2 overnight Group Larrosa_I
15	09:46:18	20250611-0934-B500_B.14-15	10	H1_Day	p69174hv	+	+	-	+	+	+	+	Ref GC-HV RO9 P4 Group Crisenza_G
24	09:41:04	20250611-0932-B500_B.14-24	10	H1_Day	p69174hv	+	+	-	+	+	+	+	Ref GC-HV RO9 P3 Group Crisenza_G
23	09:34:39	20250611-0932-B500_B.14-23	10	H1_Day	p69174hv	+	+	-	+	+	+	+	Ref GC-HV RO9 P2 Group Crisenza_G
49	09:26:36	20250611-0919-B500_B.14-49	10	H1_Day	c46714th	+	+	-	+	+	+	+	Ref TH-539-001-rm Group James_M
48	09:20:38	20250611-0918-B500_B.14-48	10	H1_Day	c46714th	+	+	-	+	+	+	+	Ref TH-538-001-rm Group James_M
45	09:14:46	20250611-0906-B500_B.14-45	10	H1_Day	b72547am	+	+	-	+	+	+	+	Ref 4-167 pr Group Larrosa_I
44	09:00:28	20250611-0900-B500_B.14-44	10	H1_Night128	x25009jo	+	+	-	+	+	+	+	Ref GDB-JO-865-1-crude Group DeBo_G
42	08:19:16	20250611-0818-B500_B.14-42	10	H1_Night128	x25009jo	+	+	-	+	+	+	+	Ref GDB-JO-864-PS-NW Group DeBo_G
17	08:04:06	20250611-0803-B500_B.14-17	10	H1_Day	mbdxkrn2	+	+	-	+	+	+	+	Ref GDB-RN1536 Prep Top Band - Acetone-d6 Group DeBo_G
3	06:50:30	20250610-1924-B500_B.14-3	16	C13_DEPT90_Night	w61916tz	-	+	-	-	-	+	+	Ref SY-TZ-TA-20250607a-DEPT90 Group Schroder_M
3	06:28:59	20250610-1924-B500_B.14-3	15	H1_C13_HSQC_Night	w61916tz	-	+	-	-	-	+	+	Ref SY-TZ-TA-20250607a-HSQC Group Schroder_M
3	06:01:28	20250610-1924-B500_B.14-3	12	C13_DEPT135_Night	w61916tz	-	+	-	-	-	+	+	Ref SY-TZ-TA-20250607a-13C-DEPT135 Group Schroder_M
3	05:46:54	20250610-1924-B500_B.14-3	11	C13_CPD_Night256	w61916tz	-	+	-	-	-	+	+	Ref SY-TZ-TA-20250607a-13C-CPD Group Schroder_M
3	05:40:39	20250610-1924-B500_B.14-3	10	H1_Night	w61916tz	+	+	-	+	+	+	+	Ref SY-TZ-TA-20250607a-1H Group Schroder_M
55	05:38:38	20250610-1809-B500_B.14-55	12	F19_NoCPD_Day	v97511sv	-	+	-	-	-	+	+	Ref DPM-SV-52 Group Mills_D Clean [Ph3C][BArF24]
55	05:34:01	20250610-1809-B500_B.14-55	11	C13_DEPTQ_Day	v97511sv	-	+	-	-	-	+	+	Ref DPM-SV-52 Group Mills_D Clean [Ph3C][BArF24]
55	05:28:13	20250610-1809-B500_B.14-55	10	H1_Day	v97511sv	+	+	-	+	x	+	+	Ref DPM-SV-52 Group Mills_D Clean [Ph3C][BArF24]
54	04:16:01	20250610-1808-B500_B.14-54	11	C13_Quant_CPD_Night	j21190dp	-	+	-	-	-	+	+	Ref akdp51 w extr c13 Group Keerthi_A
54	04:01:54	20250610-1808-B500_B.14-54	10	H1quant_Day	j21190dp	+	+	-	+	+	+	+	Ref akdp51 w extr h1 Group Keerthi_A
53	03:56:27	20250610-1752-B500_B.14-53	10	H1_Day	m52750pm	+	+	-	+	+	+	+	Ref GCPM52F2 Group Crisenza_G
52	03:49:27	20250610-1752-B500_B.14-52	10	H1_Day	m52750pm	+	+	-	+	+	+	+	Ref GCPM52F1 Group Crisenza_G
41	03:35:02	20250610-1746-B500_B.14-41	13	C13_CPD_Night256	p16600hw	-	+	-	-	-	+	+	Ref mfg-whw20250610-1 Group Greaney_M
41	03:06:14	20250610-1746-B500_B.14-41	12	C13_DEPT135_Night	p16600hw	-	+	-	-	-	+	+	Ref mfg-whw20250610-1 Group Greaney_M
41	03:04:12	20250610-1746-B500_B.14-41	11	F19_NoCPD_Day	p16600hw	-	+	-	-	-	+	+	Ref mfg-whw20250610-1 Group Greaney_M
41	02:57:21	20250610-1746-B500_B.14-41	10	H1_Day	p16600hw	+	+	-	+	+	+	+	Ref mfg-whw20250610-1 Group Greaney_M
22	02:51:31	20250610-1723-B500_B.14-22	10	H1_Day	j34309ms	+	+	-	+	+	+	+	Ref 2,6-dip-CDCL3 Group Mills_D
16	02:19:53	20250610-1607-B500_B.14-16	15	H1_C13_HMBC_Night	d47555aa	-	+	-	-	-	+	+	Ref DJP-ASA-1151 char Group Procter_D
16	01:58:17	20250610-1607-B500_B.14-16	14	H1_C13_HSQC_Night	d47555aa	-	+	-	-	-	+	+	Ref DJP-ASA-1151 char Group Procter_D
16	01:16:25	20250610-1607-B500_B.14-16	13	H1_COSY_HiRes_Night	d47555aa	-	+	-	-	-	+	+	Ref DJP-ASA-1151 char Group Procter_D
16	00:48:53	20250610-1607-B500_B.14-16	12	C13_DEPT135_Night	d47555aa	-	+	-	-	-	+	+	Ref DJP-ASA-1151 char Group Procter_D
16	00:34:25	20250610-1607-B500_B.14-16	11	C13_CPD_Night256	d47555aa	-	+	-	-	-	+	+	Ref DJP-ASA-1151 char Group Procter_D
16	00:27:31	20250610-1607-B500_B.14-16	10	H1_Night	d47555aa	+	+	-	+	+	+	+	Ref DJP-ASA-1151 char Group Procter_D
57	23:56:31	20250610-1516-B500_B.14-57	14	H1_C13_HMBC_US_Night	b32507dt	-	+	-	-	-	+	+	Ref cholestanol linker (click) Group Webb_S
57	23:34:40	20250610-1516-B500_B.14-57	13	H1_C13_HSQC_Night	b32507dt	-	+	-	-	-	+	+	Ref cholestanol linker (click) Group Webb_S
57	23:30:41	20250610-1516-B500_B.14-57	12	H1_Night	b32507dt	-	+	-	-	-	+	+	Ref cholestanol linker (click) Group Webb_S
57	23:12:26	20250610-1516-B500_B.14-57	11	C13_CPD_Night256	b32507dt	+	+	-	+	+	+	+	Ref cholestanol linker (click) Group Webb_S
56	22:53:21	20250610-1515-B500_B.14-56	12	C13_CPD_Night256	b32507dt	+	+	-	+	+	+	+	Ref dtlinker 2 Group Webb_S
2	21:42:00	20250610-1432-B500_B.14-2	10	H1_1024_Night	y37570lc	+	+	-	+	+	+	+	Ref lc612-1 post sonc E1151 Group DeBo_G
1	20:30:01	20250610-1432-B500_B.14-1	10	H1_1024_Night	y37570lc	+	+	-	+	+	+	+	Ref lc612-1 post sonc E1150 Group DeBo_G
21	20:10:27	20250610-1032-B500_B.14-21	12	C13_CPD_Night256	b32507dt	+	+	-	+	+	+	+	Ref ZSerNHtBu Group Webb_S
20	19:51:03	20250610-1031-B500_B.14-20	12	C13_CPD_Night256	b32507dt	+	+	-	+	+	+	+	Ref dtH2NSerNHtBu Group Webb_S
47	19:08:32	20250609-1929-B500_B.14-47	11	H1_COSY_HiRes_Night	z40973rs	-	+	-	-	-	+	+	Ref gdb-rs-95 cdcl3 Group DeBo_G
47	18:54:12	20250609-1929-B500_B.14-47	10	H1_Night128	z40973rs	+	+	-	+	+	+	+	Ref gdb-rs-95 cdcl3 Group DeBo_G
46	18:06:29	20250609-1928-B500_B.14-46	11	H1_COSY_HiRes_Night	z40973rs	+	+	-	+	+	+	+	Ref gdb-rs-94 cdcl3 Group DeBo_G
10	18:03:05	20250610-1700-B500_B.14-10	12	C13_DEPT135_Day	a74776dr	-	+	-	-	-	+	+	Ref DJP-DR-1-253 Group Procter_D
10	17:59:21	20250610-1700-B500_B.14-10	11	C13_CPD_Day	a74776dr	-	+	-	-	-	+	+	Ref DJP-DR-1-253 Group Procter_D
10	17:52:27	20250610-1700-B500_B.14-10	10	H1_Day	a74776dr	+	+	-	+	+	+	+	Ref DJP-DR-1-253 Group Procter_D
5	17:49:48	20250610-1732-B500_B.14-5	12	F19_NoCPD_Day	q49270na	-	+	-	-	-	+	+	Ref 32a Group Greaney_M
5	17:45:40	20250610-1732-B500_B.14-5	11	C13_CPD_Day	q49270na	-	+	-	-	-	+	+	Ref 32a Group Greaney_M
5	17:39:07	20250610-1732-B500_B.14-5	10	H1_Day	q49270na	+	+	-	+	+	+	+	Ref 32a Group Greaney_M
48	17:32:04	20250610-1616-B500_B.14-48	10	H1_Day	m52750pm	+	+	-	+	+	+	+	Ref GCPM54wup-2 Group Crisenza_G
40	17:24:12	20250610-1640-B500_B.14-40	10	H1_Day	m75418lc	+	+	-	+	+	+	+	Ref LC_LN_4 Group Natrajan_L
19	17:21:58	20250610-1705-B500_B.14-19	11	H1_ExtraWide_Day	n38871ln	-	+	-	-	-	+	+	Ref ln83-2 4h Group Larrosa_I
19	17:07:43	20250610-1705-B500_B.14-19	10	H1quant_Day	n38871ln	+	+	-	+	+	+	+	Ref ln83-2 4h Group Larrosa_I
18	17:00:45	20250610-1639-B500_B.14-18	10	H1_Day	m75418lc	+	+	-	+	+	+	+	Ref LC_LN_7 Group Natrajan_L
9	16:53:51	20250610-1638-B500_B.14-9	10	H1_Day	m75418lc	+	+	-	+	+	+	+	Ref LC_LN_6 Group Natrajan_L
4	16:46:39	20250610-1625-B500_B.14-4	10	H1_Day	m90460ad	+	+	-	+	+	+	+	Ref mfg-ad-380a Group Greaney_M
3	16:40:04	20250610-1624-B500_B.14-3	10	H1_Day	m90460ad	+	+	-	+	+	+	+	Ref mfg-ad-382n2 Group Greaney_M
60	16:35:51	20250610-1614-B500_B.14-60	11	C13_CPD_Day	q85514th	-	+	-	-	-	+	+	Ref 1601DI-Ns Group Greaney_M
60	16:29:13	20250610-1614-B500_B.14-60	10	H1_Day	q85514th	+	+	-	+	+	+	+	Ref 1601DI-Ns Group Greaney_M
58	16:27:09	20250610-1612-B500_B.14-58	12	F19_NoCPD_Day	q85514th	-	+	-	-	-	+	+	Ref 101DI-Ns Group Greaney_M
58	16:23:59	20250610-1612-B500_B.14-58	11	C13_CPD_Day	q85514th	-	+	-	-	-	+	+	Ref 101DI-Ns Group Greaney_M
58	16:17:45	20250610-1612-B500_B.14-58	10	H1_Day	q85514th	+	+	-	+	+	+	+	Ref 101DI-Ns Group Greaney_M
55	16:11:34	20250610-1610-B500_B.14-55	10	H1_Day	z65435tw	+	+	-	+	+	+	+	Ref tw-enolether-1h-cdcl3 Group Crisenza_G
54	16:07:14	20250610-1552-B500_B.14-54	12	C13_CPD_Day	z86427mk	-	+	-	-	-	+	+	Ref MK-179 F9-15 Group Procter_D
54	16:05:05	20250610-1552-B500_B.14-54	11	F19_NoCPD_Day	z86427mk	-	+	-	-	-	+	+	Ref MK-179 F9-15 Group Procter_D
54	15:59:14	20250610-1552-B500_B.14-54	10	H1_Day	z86427mk	+	+	-	+	+	+	+	Ref MK-179 F9-15 Group Procter_D
53	15:53:09	20250610-1547-B500_B.14-53	10	H1_Day	e03178pd	+	+	-	+	+	+	+	Ref IL-pdl715.recol.F1 Group Larrosa_I
52	15:47:54	20250610-1540-B500_B.14-52	10	H1_ExtraWide_Day	mbdxjsl5	+	+	-	+	x	+	+	Ref SJL_GT56-25 Group Mcinnes_E
51	15:42:44	20250610-1539-B500_B.14-51	10	H1_ExtraWide_Day	mbdxjsl5	+	+	-	+	x	+	+	Ref SJL_GT54-25 Group Mcinnes_E
58	15:36:51	20250610-1532-B500_B.14-58	10	H1_Day	z65435tw	+	+	-	+	+	+	+	Ref tw-1029-c-1h-cdcl3 Group Crisenza_G
57	15:30:40	20250610-1516-B500_B.14-57	10	H1_Day	b32507dt	+	+	-	+	+	+	+	Ref cholestanol linker (click) Group Webb_S
56	15:24:24	20250610-1515-B500_B.14-56	11	H1_COSY_Day	b32507dt	-	+	-	-	-	+	+	Ref dtlinker 2 Group Webb_S
56	15:18:15	20250610-1515-B500_B.14-56	10	H1_Day	b32507dt	+	+	-	+	+	+	+	Ref dtlinker 2 Group Webb_S
55	15:11:48	20250610-1429-B500_B.14-55	10	H1_Day	m52750pm	+	+	-	+	+	+	+	Ref GCPM52cru-2 Group Crisenza_G
39	15:06:07	20250610-1427-B500_B.14-39	10	H1_Wide_Day	n47913ps	+	+	-	+	+	+	+	Ref MD-PS Group Other PS-JEFF
38	15:00:39	20250610-1426-B500_B.14-38	10	H1_Wide_Day	n47913ps	+	+	-	+	+	+	+	Ref MD-PS Group Other PS-GLY
37	14:55:06	20250610-1425-B500_B.14-37	10	H1_Wide_Day	n47913ps	+	+	-	+	+	+	+	Ref MD-PS Group Other PS-PCL
36	14:50:14	20250610-1424-B500_B.14-36	10	H1_Wide_Day	n47913ps	+	+	-	+	+	+	+	Ref md-gc Group Other gc-gelatina
35	14:45:25	20250610-1423-B500_B.14-35	10	H1_Wide_Day	n47913ps	+	+	-	+	+	+	+	Ref MD-GC Group Other GC-2
34	14:40:35	20250610-1423-B500_B.14-34	10	H1_Wide_Day	n47913ps	+	+	-	+	+	+	+	Ref md-gc Group Other gc-3
33	14:35:28	20250610-1420-B500_B.14-33	10	H1_Wide_Day	n47913ps	+	+	-	+	+	+	+	Ref MD-GC Group Other gc-4
30	14:33:38	20250610-1416-B500_B.14-30	11	H1_ExtraWide_Day	n38871ln	-	+	-	-	-	+	+	Ref ln83-2 1.45 h Group Larrosa_I
30	14:19:55	20250610-1416-B500_B.14-30	10	H1quant_Day	n38871ln	+	+	-	+	+	+	+	Ref ln83-2 1.45 h Group Larrosa_I
29	14:05:03	20250610-1342-B500_B.14-28	20	H1quant_Day	z40241jm	+	+	-	+	+	+	+	Ref DJP-JIM-6-127-1c Group Procter_D
28	13:50:33	20250610-1342-B500_B.14-28	10	H1quant_Day	z40241jm	+	+	-	+	+	+	+	Ref DJP-JIM-6-127-1b Group Procter_D
27	13:44:37	20250610-1343-B500_B.14-27	10	H1_Day	h68355ac	+	+	-	+	+	+	+	Ref MFG-AC-560-2 Group Greaney_M
26	13:39:21	20250610-1333-B500_B.14-26	10	F19_NoCPD_Day	u67812sg	+	+	-	+	+	+	+	Ref sq-01-113 Group Procter_D
25	13:37:17	20250610-1310-B500_B.14-25	11	F19_NoCPD_Day	c62220rg	-	+	-	-	-	+	+	Ref at-rg-4-27-2 Group Trowbridge_A
25	13:31:11	20250610-1310-B500_B.14-25	10	H1_Day	c62220rg	+	+	-	+	+	+	+	Ref at-rg-4-27-2 Group Trowbridge_A
24	13:25:54	20250610-1227-B500_B.14-24	10	H1_Day	mbyxaac2	+	+	-	+	+	+	+	Ref DP-AC-394 Group Butterworth_S
23	13:19:09	20250610-1219-B500_B.14-23	10	H1_Day	e02956op	+	+	-	+	+	+	+	Ref GDB-OP0283B-StabilityTest Group DeBo_G
22	13:12:26	20250610-1052-B500_B.14-22	10	H1_Day	j31752jy	+	+	-	+	+	+	+	Ref JY022-HEA30-t1 Group Gibson_M
21	13:00:38	20250610-1032-B500_B.14-21	11	H1_COSY_Day	b32507dt	+	+	-	+	+	+	+	Ref ZSerNHtBu Group Webb_S
19	12:57:53	20250610-1247-B500_B.14-19	13	H1_Day	h32367lm	-	+	-	-	-	+	+	Ref LM34col Group Leigh_D
19	12:55:46	20250610-1247-B500_B.14-19	12	F19_NoCPD_Day	h32367lm	-	+	-	-	-	+	+	Ref LM34col Group Leigh_D
19	12:54:32	20250610-1247-B500_B.14-19	11	F19_NoCPD_Day	h32367lm	-	+	-	-	-	+	+	Ref LM34col Group Leigh_D
19	12:47:37	20250610-1247-B500_B.14-19	10	F19_NoCPD_Day	h32367lm	+	+	-	+	+	+	+	Ref LM34col Group Leigh_D
21	10:53:43	20250610-1032-B500_B.14-21	10	H1_Day	b32507dt	+	+	-	+	+	+	+	Ref ZSerNHtBu Group Webb_S
20	10:47:38	20250610-1031-B500_B.14-20	11	H1_COSY_Day	b32507dt	-	+	-	-	-	+	+	Ref dtH2NSerNHtBu Group Webb_S
20	10:41:55	20250610-1031-B500_B.14-20	10	H1_Day	b32507dt	+	+	-	+	+	+	+	Ref dtH2NSerNHtBu Group Webb_S
17	10:35:48	20250610-1028-B500_B.14-17	11	H1_COSY_Day	b32507dt	-	+	-	-	-	+	+	Ref cholestanol click linker Group Webb_S
17	10:30:16	20250610-1028-B500_B.14-17	10	H1_Day	b32507dt	+	+	-	+	+	+	+	Ref cholestanol click linker Group Webb_S
16	10:20:07	20250610-1018-B500_B.14-16	10	H1_Day	q85514th	+	+	-	+	+	+	+	Ref 00XDI-Ns Group Greaney_M
15	10:10:04	20250610-1000-B500_B.14-15	12	F19_NoCPD_Day	z40241jm	-	+	-	-	-	+	+	Ref DJP-JIM-6-125-recryst.desilyl. Group Procter_D
15	10:07:03	20250610-1000-B500_B.14-15	11	C13_CPD_Day	z40241jm	-	+	-	-	-	+	+	Ref DJP-JIM-6-125-recryst.desilyl. Group Procter_D
15	10:01:03	20250610-1000-B500_B.14-15	10	H1_Day	z40241jm	+	+	-	+	+	+	+	Ref DJP-JIM-6-125-recryst.desilyl. Group Procter_D
31	09:32:17	20250610-0924-B500_B.14-31	11	F19_NoCPD_Night	c62220rg	-	+	-	-	-	+	+	Ref at-rg-4-27-p1 Group Trowbridge_A
31	09:24:52	20250610-0924-B500_B.14-31	10	H1_Day	c62220rg	+	+	-	+	+	+	+	Ref at-rg-4-27-p1 Group Trowbridge_A
26	09:16:51	20250610-0910-B500_B.14-26	11	F19_NoCPD_Day	c46714th	-	+	-	-	-	+	+	Ref TH-527-001-rm Group James_M
26	09:11:01	20250610-0910-B500_B.14-26	10	H1_Day	c46714th	+	+	-	+	+	+	+	Ref TH-527-001-rm Group James_M
46	08:33:23	20250609-1928-B500_B.14-46	10	H1_Night128	z40973rs	+	+	-	+	+	+	+	Ref gdb-rs-94 cdcl3 Group DeBo_G
45	07:51:30	20250609-1921-B500_B.14-45	11	H1_COSY_HiRes_Night	z40973rs	-	+	-	-	-	+	+	Ref gdb-rs-95 dmso Group DeBo_G
45	07:38:23	20250609-1921-B500_B.14-45	10	H1_Night128	z40973rs	+	+	-	+	+	+	+	Ref gdb-rs-95 dmso Group DeBo_G
44	06:56:29	20250609-1920-B500_B.14-44	11	H1_COSY_HiRes_Night	z40973rs	-	+	-	-	-	+	+	Ref gdb-rs-94 dmso Group DeBo_G
44	06:43:16	20250609-1920-B500_B.14-44	10	H1_Night128	z40973rs	+	+	-	+	+	+	+	Ref gdb-rs-94 dmso Group DeBo_G
16	05:31:02	20250609-1905-B500_B.14-16	12	C13_Quant_CPD_Night	j21190dp	-	+	-	-	-	+	+	Ref akdp51 water c13 Group Keerthi_A
16	05:19:58	20250609-1905-B500_B.14-16	11	H1_Quant_Wide_Night	j21190dp	-	+	-	-	-	+	+	Ref akdp51 water h1 n Group Keerthi_A
16	05:05:45	20250609-1905-B500_B.14-16	10	H1quant_Day	j21190dp	+	+	-	+	+	+	+	Ref akdp51 water h1 Group Keerthi_A
50	05:00:07	20250609-1838-B500_B.14-50	10	H1_Day	m52750pm	+	+	-	+	+	+	+	Ref GCPM49F2 Group Crisenza_G
49	04:52:51	20250609-1838-B500_B.14-49	10	H1_Day	m52750pm	+	+	-	+	+	+	+	Ref GCPM49F1 Group Crisenza_G
12	03:40:41	20250609-1824-B500_B.14-12	12	C13_Quant_CPD_Night	j21190dp	-	+	-	-	-	+	+	Ref akdp51 h1 Group Keerthi_A
12	03:34:10	20250609-1824-B500_B.14-12	11	H1_Quant_Night	j21190dp	-	+	-	-	-	+	+	Ref akdp51 h1 Group Keerthi_A
12	03:18:46	20250609-1824-B500_B.14-12	10	H1quant_Day	j21190dp	+	+	-	+	+	+	+	Ref akdp51 h1 Group Keerthi_A
13	03:11:14	20250609-1713-B500_B.14-13	10	H1_Night	j31752jy	+	+	-	+	+	+	+	Ref JY022-HEA30 Group Gibson_M
43	02:56:48	20250609-1703-B500_B.14-41	31	C13_CPD_Night256	b26045ab	-	+	-	-	-	+	+	Ref AT-ABO-02-343-P3 Group Trowbridge_A
43	02:51:08	20250609-1703-B500_B.14-41	30	H1_Night	b26045ab	+	+	-	+	+	+	+	Ref AT-ABO-02-343-P3 Group Trowbridge_A
42	02:36:42	20250609-1703-B500_B.14-41	21	C13_CPD_Night256	b26045ab	-	+	-	-	-	+	+	Ref AT-ABO-02-343-P2 Group Trowbridge_A
42	02:31:24	20250609-1703-B500_B.14-41	20	H1_Night	b26045ab	+	+	-	+	+	+	+	Ref AT-ABO-02-343-P2 Group Trowbridge_A
41	02:16:52	20250609-1703-B500_B.14-41	11	C13_CPD_Night256	b26045ab	-	+	-	-	-	+	+	Ref AT-ABO-02-343-P1 Group Trowbridge_A
41	02:10:18	20250609-1703-B500_B.14-41	10	H1_Night	b26045ab	+	+	-	+	+	+	+	Ref AT-ABO-02-343-P1 Group Trowbridge_A
19	01:55:19	20250609-1651-B500_B.14-19	11	C13_CPD_Night256	q80578pk	-	+	-	-	-	+	+	Ref MJJ-PK-01-006-pure Group Other
19	01:48:43	20250609-1651-B500_B.14-19	10	H1_Day	q80578pk	+	+	-	+	+	+	+	Ref MJJ-PK-01-006-pure Group Other
4	01:45:47	20250609-1640-B500_B.14-4	11	C13_CPD_Day	t13367jb	-	+	-	-	-	+	+	Ref mfg-jb-04-097-reagent Group Greaney_M mfg-jb-04-097-reagent
4	01:39:05	20250609-1640-B500_B.14-4	10	H1_Day	t13367jb	+	+	-	+	+	+	+	Ref mfg-jb-04-097-reagent Group Greaney_M mfg-jb-04-097-reagent
18	01:36:09	20250609-1440-B500_B.14-18	11	C13_CPD_Day	m75418lc	-	+	-	-	-	+	+	Ref LC_LN_2 Group Natrajan_L
18	01:31:02	20250609-1440-B500_B.14-18	10	H1_Day	m75418lc	+	+	-	+	+	+	+	Ref LC_LN_2 Group Natrajan_L
15	01:23:55	20250609-1439-B500_B.14-15	10	H1_Day	m75418lc	+	+	-	+	+	+	+	Ref LC_LN_1 Group Natrajan_L
17	00:52:23	20250609-1340-B500_B.14-17	12	H1_C13_HMBC_Night	b32507dt	-	+	-	-	-	+	+	Ref SJW-PY1 Group Webb_S
17	00:30:51	20250609-1340-B500_B.14-17	11	H1_C13_HSQC_Night	b32507dt	-	+	-	-	-	+	+	Ref SJW-PY1 Group Webb_S
17	00:23:18	20250609-1340-B500_B.14-17	10	H1_Night	b32507dt	+	+	-	+	+	+	+	Ref SJW-PY1 Group Webb_S
8	23:12:32	20250609-1224-B500_B.14-8	10	H1_1024_Night	y37570lc	+	+	-	+	+	+	+	Ref lc613-1 MeOH E1149 Group DeBo_G
7	22:01:42	20250609-1224-B500_B.14-7	10	H1_1024_Night	y37570lc	+	+	-	+	+	+	+	Ref lc613-1 polymer E1149 Group DeBo_G
6	20:50:47	20250609-1223-B500_B.14-6	10	H1_1024_Night	y37570lc	+	+	-	+	+	+	+	Ref lc613-1 MeOH E1148 Group DeBo_G
5	19:38:23	20250609-1223-B500_B.14-5	10	H1_1024_Night	y37570lc	+	+	-	+	+	+	+	Ref lc613-1 polymer E1148 Group DeBo_G
10	18:20:47	20250608-1542-B500_B.14-10	12	C13_Quant_CPD_Night	j21190dp	+	+	-	+	+	+	+	Ref akdp hatome waste d2o 13c Group Keerthi_A
12	18:17:46	20250609-1436-B500_B.14-12	12	H1_Day	u67812sg	-	+	-	-	-	+	+	Ref sq-01-113 Group Procter_D
12	18:15:09	20250609-1436-B500_B.14-12	11	F19_NoCPD_Day	u67812sg	-	+	-	-	-	+	+	Ref sq-01-113 Group Procter_D
12	14:36:58	20250609-1436-B500_B.14-12	10	C13_CPD_Day	u67812sg	+	+	-	+	+	+	+	Ref sq-01-113 Group Procter_D
3	14:27:01	20250609-1425-B500_B.14-3	10	H1_Day	b90273gm	+	+	-	+	+	+	+	Ref STL-GM-CRA002-B Group Liddle_S NBBr, 2nd crop, CDCl3
1	14:16:14	20250609-1415-B500_B.14-1	10	F19_NoCPD_Day	m90460ad	+	+	-	+	+	+	+	Ref mfg-ad-382b Group Greaney_M
42	14:02:39	20250609-1357-B500_B.14-42	10	H1_Day	f14199vs	+	+	-	+	+	+	+	Ref vs540-lastf-ppt Group Keerthi_A
41	13:57:01	20250609-1356-B500_B.14-41	10	H1_Day	f14199vs	+	+	-	+	+	+	+	Ref vs540-1f-ppt Group Keerthi_A
51	13:19:40	20250609-1311-B500_B.14-51	11	C13_CPD_Day	m90460ad	-	+	-	-	-	+	+	Ref mfg-ad-382b Group Greaney_M
51	13:13:35	20250609-1311-B500_B.14-51	10	H1_Day	m90460ad	+	+	-	+	+	+	+	Ref mfg-ad-382b Group Greaney_M
50	13:11:44	20250609-1243-B500_B.14-50	11	F19_NoCPD_Day	m52750pm	-	+	-	-	-	+	+	Ref GCPM50cru Group Crisenza_G
50	13:05:28	20250609-1243-B500_B.14-50	10	H1_Day	m52750pm	+	+	-	+	+	+	+	Ref GCPM50cru Group Crisenza_G
15	12:59:14	20250609-1248-B500_B.14-15	10	C13_CPD_Day	j04069am	+	+	-	+	+	+	+	Ref BD1_Run_2_2_09_06_2025 Group Other
9	12:40:41	20250608-1357-B500_B.14-9	13	C13_CPD_Night256	p10556ha	+	+	-	+	+	+	+	Ref HA54f1 c13 Group Keerthi_A
59	12:39:45	20250609-1038-B500_B.14-59	10	C13_CPD_Night256	p10556ha	x	-	-	-	-	-	-	Ref HA54f1 Group Keerthi_A	Sample Changer: Error: SKIP_SAMPLE :: Error: No sample in position 59
20	12:36:42	20250609-1211-B500_B.14-20	11	C13_CPD_Day	t13367jb	-	+	-	-	-	+	+	Ref mfg-jb-04-097-pc2 Group Greaney_M mfg-jb-04-097-pc2
20	12:31:11	20250609-1211-B500_B.14-20	10	H1_Day	t13367jb	+	+	-	+	+	+	+	Ref mfg-jb-04-097-pc2 Group Greaney_M mfg-jb-04-097-pc2
19	12:28:15	20250609-1159-B500_B.14-19	11	C13_CPD_Day	q85514th	-	+	-	-	-	+	+	Ref 80XDI-product Group Greaney_M
19	12:22:39	20250609-1159-B500_B.14-19	10	H1_Day	q85514th	+	+	-	+	+	+	+	Ref 80XDI-product Group Greaney_M
18	12:19:30	20250609-1159-B500_B.14-18	11	C13_CPD_Day	q85514th	-	+	-	-	-	+	+	Ref 50XDI-product Group Greaney_M
18	12:13:18	20250609-1159-B500_B.14-18	10	H1_Day	q85514th	+	+	-	+	+	+	+	Ref 50XDI-product Group Greaney_M
17	12:11:22	20250609-1159-B500_B.14-17	12	F19_NoCPD_Day	q85514th	-	+	-	-	-	+	+	Ref 30XDI-product Group Greaney_M
17	12:08:26	20250609-1159-B500_B.14-17	11	C13_CPD_Day	q85514th	-	+	-	-	-	+	+	Ref 30XDI-product Group Greaney_M
17	12:02:07	20250609-1159-B500_B.14-17	10	H1_Day	q85514th	+	+	-	+	+	+	+	Ref 30XDI-product Group Greaney_M
16	11:56:20	20250609-1145-B500_B.14-16	10	H1_Day	y38246dt	+	+	-	+	+	+	+	Ref GDB-DT-909-Cr Group DeBo_G GDB-DT-909-Cr
15	11:50:48	20250609-1140-B500_B.14-15	10	H1_Day	j04069am	+	+	-	+	+	+	+	Ref BD1_Run_2_09_06_2025 Group Other
14	11:49:59	20250609-1139-B500_B.14-14	10	H1_Day	j04069am	x	-	-	-	-	-	-	Ref BD1_Run_2_Fr_ Group Other	Sample Changer: Error: SKIP_SAMPLE :: Error: No sample in position 14
13	11:43:28	20250609-1135-B500_B.14-13	10	H1_Day	p69174hv	+	+	-	+	+	+	+	Ref GC-HV RO8 P? Group Crisenza_G
8	11:39:23	20250609-1109-B500_B.14-8	12	C13_CPD_Day	u67812sg	-	+	-	-	-	+	+	Ref sq-01-113 Group Procter_D
8	11:37:42	20250609-1109-B500_B.14-8	11	F19_NoCPD_Day	u67812sg	-	+	-	-	-	+	+	Ref sq-01-113 Group Procter_D
8	11:30:57	20250609-1109-B500_B.14-8	10	H1_Day	u67812sg	+	+	-	+	+	+	+	Ref sq-01-113 Group Procter_D
7	11:25:22	20250609-1108-B500_B.14-5	30	H1_Day	b26045ab	+	+	-	+	+	+	+	Ref AT-ABO-02-343-cr Group Trowbridge_A
6	11:19:43	20250609-1108-B500_B.14-5	20	H1_Day	b26045ab	+	+	-	+	+	+	+	Ref AT-ABO-02-342-iso Group Trowbridge_A
5	11:13:25	20250609-1108-B500_B.14-5	10	H1_Day	b26045ab	+	+	-	+	+	+	+	Ref AT-ABO-02-341-iso Group Trowbridge_A
4	11:07:22	20250609-1106-B500_B.14-4	10	H1_Day	h91839em	+	+	-	+	+	+	+	Ref GC EM 37 C Group Crisenza_G
32	11:06:18	20250609-1040-B500_B.14-32	10	H1_Day	j04069am	x	-	-	-	-	-	-	Ref BD_1_Run_2 Group Other	Sample Changer: Error: SKIP_SAMPLE :: Error: No sample in position 32
2	11:00:43	20250609-1056-B500_B.14-2	10	H1_Day	z65435tw	+	+	-	+	+	+	+	Ref tw-4czipn-1h-cdcl3 Group Crisenza_G
1	10:54:58	20250609-1051-B500_B.14-1	10	H1_Day	z86427mk	+	+	-	+	+	+	+	Ref MK-173-A F1 Group Procter_D
60	10:36:38	20250609-1036-B500_B.14-60	10	C13_CPD_Night256	p10556ha	+	+	-	+	+	+	+	Ref HA62 c13 Group Keerthi_A
59	10:35:46	20250609-1034-B500_B.14-59	10	C13_CPD_Night256	p10556ha	x	-	-	-	-	-	-	Ref HA54f1 c13 Group Keerthi_A	Sample Changer: Error: SKIP_SAMPLE :: Error: No sample in position 59
58	09:56:21	20250609-0847-B500_B.14-50	90	H1_Day	y59240mb	+	+	-	+	+	+	+	Ref 50 microlit R3 in 650 microlid in cdcl3 mazrina Group McDonald_T 50 microlit R3 in 650 microlid in cdcl3 mazrina
57	09:49:26	20250609-0847-B500_B.14-50	80	H1_Day	y59240mb	+	+	-	+	+	+	+	Ref 50 microlit R2 in 650 microlid in cdcl3 mazrina Group McDonald_T 50 microlit R1 in 650 microlid in cdcl3 mazrina
56	09:43:33	20250609-0847-B500_B.14-50	70	H1_Day	y59240mb	+	+	-	+	+	+	+	Ref 50 microlit R1 in 650 microlid in cdcl3 mazrina Group McDonald_T 50 microlit R1 in 650 microlid in cdcl3 mazrina
55	09:37:09	20250609-0847-B500_B.14-50	60	H1_Day	y59240mb	+	+	-	+	+	+	+	Ref 50 microlid 2 propanol in 650 microlid in cldl3 mazrina Group McDonald_T 50 microlid 2 propanol in 650 microlid in cldl3 mazrina
54	09:31:28	20250609-0847-B500_B.14-50	50	H1_Day	y59240mb	+	+	-	+	+	+	+	Ref cta in 650 microlid in cdcl3 mazrina Group McDonald_T aibn in 650 microlid in cdcl3 mazrina
53	09:25:41	20250609-0847-B500_B.14-50	40	H1_Day	y59240mb	+	+	-	+	+	+	+	Ref aibn in 650 microlid in cdcl3mazrina Group McDonald_T aibn in 650 microlid in cldl3 mazrina
52	09:20:23	20250609-0847-B500_B.14-50	30	H1_Day	y59240mb	+	+	-	+	+	+	+	Ref R3 RAFT 0 h 50 microlid in 650 microlid in d2o mazrina Group McDonald_T R3 RAFT 0 h 50 microlid in 650 microlid in d2o mazrina
51	09:14:16	20250609-0847-B500_B.14-50	20	H1_Day	y59240mb	+	+	-	+	+	+	+	Ref R2 RAFT 0 h 50 microlid in 650 microlid in d2o mazrina Group McDonald_T R2 RAFT 0 h 50 microlid in 650 microlid in d2o mazrina
50	09:08:02	20250609-0847-B500_B.14-50	10	H1_Day	y59240mb	+	+	-	+	+	+	+	Ref R1 RAFT 0 h 50 microlid in 650 microlid in d2o mazrina Group McDonald_T R1 RAFT 0 h 50 microlid in 650 microlid in d2o mazrina
11	08:29:07	20250608-1933-B500_B.14-11	10	H1_Day	z83527ql	x	-	-	-	-	-	-	Ref qlt-p28 Group Leigh_D	Sample Changer: Error: SKIP_SAMPLE :: Error: No sample in position 11
10	08:23:47	20250608-1542-B500_B.14-10	11	H1_WaterSupp_Day	j21190dp	-	+	-	-	-	+	+	Ref akdp hatome waste d2o 1h supp. Group Keerthi_A
10	08:10:09	20250608-1542-B500_B.14-10	10	H1quant_Day	j21190dp	+	+	-	+	+	+	+	Ref akdp hatome waste d2o 1h Group Keerthi_A
9	06:59:25	20250608-1357-B500_B.14-9	10	H1_1024_Night	y37570lc	+	+	-	+	+	+	+	Ref lc syring only Group DeBo_G
8	05:48:23	20250608-1357-B500_B.14-8	10	H1_1024_Night	y37570lc	+	+	-	+	+	+	+	Ref lc611-1 Group DeBo_G
7	04:37:33	20250608-1356-B500_B.14-7	10	H1_1024_Night	y37570lc	+	+	-	+	+	+	+	Ref lc613-1 post sonc E1149 Group DeBo_G
6	03:26:39	20250608-1356-B500_B.14-6	10	H1_1024_Night	y37570lc	+	+	-	+	+	+	+	Ref lc613-1 post sonc E1148 Group DeBo_G
5	02:15:41	20250608-1356-B500_B.14-5	10	H1_1024_Night	y37570lc	+	+	-	+	+	+	+	Ref lc613-1 Group DeBo_G
4	01:03:21	20250608-1356-B500_B.14-4	10	H1_1024_Night	y37570lc	+	+	-	+	+	+	+	Ref lc612-1 Group DeBo_G
3	00:48:55	20250608-1245-B500_B.14-3	11	C13_CPD_Night256	f56027ch	-	+	-	-	-	+	+	Ref 2 C Group Schroder_M
3	00:43:53	20250608-1245-B500_B.14-3	10	H1_Day	f56027ch	+	+	-	+	+	+	+	Ref 2 H Group Schroder_M
2	00:29:22	20250608-1245-B500_B.14-2	11	C13_CPD_Night256	f56027ch	-	+	-	-	-	+	+	Ref 1 C Group Schroder_M
2	00:24:24	20250608-1245-B500_B.14-2	10	H1_Day	f56027ch	+	+	-	+	+	+	+	Ref 1 H Group Schroder_M
1	22:16:16	20250608-1221-B500_B.14-1	17	H1_TOCSY_Night	f85241bm	-	+	-	-	-	+	+	Ref BM919-2D Group Bures_J
1	19:59:15	20250608-1221-B500_B.14-1	16	H1_NOESY_Night	f85241bm	-	+	-	-	-	+	+	Ref BM919-2D Group Bures_J
1	19:05:20	20250608-1221-B500_B.14-1	15	C13_CPD_Night256	f85241bm	-	+	-	-	-	+	+	Ref BM919-2D Group Bures_J
1	17:06:31	20250608-1221-B500_B.14-1	14	H1_C13_HMBC_Night	f85241bm	-	+	-	-	-	+	+	Ref BM919-2D Group Bures_J
1	14:30:04	20250608-1221-B500_B.14-1	13	H1_C13_HSQC_Night	f85241bm	-	+	-	-	-	+	+	Ref BM919-2D Group Bures_J
1	12:31:32	20250608-1221-B500_B.14-1	12	H1_COSY_NS32_Night	f85241bm	-	+	-	-	-	+	+	Ref BM919-2D Group Bures_J
1	12:29:28	20250608-1221-B500_B.14-1	11	H1_Night	f85241bm	-	+	-	-	-	+	+	Ref BM919-2D Group Bures_J
1	12:22:45	20250608-1221-B500_B.14-1	10	H1_Day	f85241bm	+	+	-	+	+	+	+	Ref BM919-2D Group Bures_J