IconNMR Automation Run Status:
Day Experiments:	00:35
Busy Until:	Tue 13:55
Night Experiments:	11:15

Setup List

Holder	Status	Name	ExpNo	Experiment	User	Time	Title
1	Submitted	20251104-0759-B400_B.14-1	12	c H1_NOESY_US_Night NOESY, ns = 4, sw = auto, centre (o1p) = auto, time = 44 min 36 sec	m14269jw	02:09:49	Ref IR-JW-3110-SPC-C6 Group Riddell_I
4	Submitted	20251104-0839-B400_B.14-4	10	n Si29_DEPT90_Night Silicon, DEPT90, proton decoupled, ns = 512, sw = 403 ppm, centre (o1p) = 0 ppm, time = 26 min 32 sec	p69506xd	00:26:32	Ref STL-XLD-Th(COTii)2-after sublimation-KOtBu Group Liddle_S
6	Completed	20251104-0954-B400_B.14-6	10	N F19_Quant_D1_8s_Day Fluorine, ns = 8, sw = 237 ppm, centre (o1p) = -100 ppm, time = 5 min 30 sec, d1 = 8 sec	c62220rg	00:03:14	Ref at-rg-5-29-r1 Group Trowbridge_A
7	Completed	20251104-0800-B400_B.14-7	11	n H1_Night128 Proton, ns = 128, sw = 20 ppm, centre (o1p) = 6 ppm, time = 10 min 56 sec	m14269jw	00:10:55	Ref IR-JW-3110-SPC-Q Group Riddell_I
7	Submitted	20251104-0800-B400_B.14-7	12	c H1_NOESY_US_Night NOESY, ns = 4, sw = auto, centre (o1p) = auto, time = 44 min 36 sec	m14269jw	02:09:49	Ref IR-JW-3110-SPC-Q Group Riddell_I
8	Submitted	20251104-0800-B400_B.14-8	12	c H1_NOESY_US_Night NOESY, ns = 4, sw = auto, centre (o1p) = auto, time = 44 min 36 sec	m14269jw	02:09:49	Ref IR-JW-3110-SPC-C343 Group Riddell_I
9	Completed	20251104-1146-B400_B.14-9	10	N H1_Day Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6.175 ppm, time = 1 min 22 sec	t13367jb	00:01:21	Ref mfg-jb-05-059-c Group Greaney_M mfg-jb-05-059-c
10	Completed	20251104-1133-B400_B.14-10	10	N F19_Quant_D1_8s_Day Fluorine, ns = 8, sw = 237 ppm, centre (o1p) = -100 ppm, time = 5 min 30 sec, d1 = 8 sec	z86427mk	00:03:14	Ref MK-258-A Group Procter_D
11	Completed	20251104-1134-B400_B.14-11	10	N F19_Quant_D1_8s_Day Fluorine, ns = 8, sw = 237 ppm, centre (o1p) = -100 ppm, time = 5 min 30 sec, d1 = 8 sec	z86427mk	00:03:14	Ref MK-258-B Group Procter_D
12	Completed	20251104-1134-B400_B.14-12	10	N F19_Quant_D1_8s_Day Fluorine, ns = 8, sw = 237 ppm, centre (o1p) = -100 ppm, time = 5 min 30 sec, d1 = 8 sec	z86427mk	00:03:14	Ref MK-258-C Group Procter_D
13	Running	20251104-1152-B400_B.14-13	10	N H1_Day Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6.175 ppm, time = 1 min 22 sec	n29715ss	00:01:21	Ref DJP-SS-originalagain Group Procter_D
14	Submitted	20251104-1134-B400_B.14-14	10	N F19_Quant_D1_8s_Day Fluorine, ns = 8, sw = 237 ppm, centre (o1p) = -100 ppm, time = 5 min 30 sec, d1 = 8 sec	z86427mk	00:03:14	Ref MK-258-D Group Procter_D
15	Submitted	20251104-1134-B400_B.14-15	10	N F19_Quant_D1_8s_Day Fluorine, ns = 8, sw = 237 ppm, centre (o1p) = -100 ppm, time = 5 min 30 sec, d1 = 8 sec	z86427mk	00:03:14	Ref MK-258-E Group Procter_D
16	Submitted	20251104-1134-B400_B.14-16	10	N F19_Quant_D1_8s_Day Fluorine, ns = 8, sw = 237 ppm, centre (o1p) = -100 ppm, time = 5 min 30 sec, d1 = 8 sec	z86427mk	00:03:14	Ref MK-258-H Group Procter_D
17	Submitted	20251104-1140-B400_B.14-17	10	N H1_Day Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6.175 ppm, time = 1 min 22 sec	j40457bh	00:01:21	Ref bhah150 Group Trowbridge_A
18	Submitted	20251104-1141-B400_B.14-18	10	N H1_Day Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6.175 ppm, time = 1 min 22 sec	j40457bh	00:01:21	Ref bhah154 Group Trowbridge_A
19	Submitted	20251104-1153-B400_B.14-19	10	N H1_Day Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6.175 ppm, time = 1 min 22 sec	n29715ss	00:01:21	Ref DJP-SS-styrene Group Procter_D
20	Submitted	20251104-1135-B400_B.14-20	10	N F19_Quant_D1_8s_Day Fluorine, ns = 8, sw = 237 ppm, centre (o1p) = -100 ppm, time = 5 min 30 sec, d1 = 8 sec	z86427mk	00:03:14	Ref MK-258-H Group Procter_D
21	Submitted	20251104-1135-B400_B.14-21	10	N F19_Quant_D1_8s_Day Fluorine, ns = 8, sw = 237 ppm, centre (o1p) = -100 ppm, time = 5 min 30 sec, d1 = 8 sec	z86427mk	00:03:14	Ref MK-258-I Group Procter_D
22	Submitted	20251104-1153-B400_B.14-22	10	N H1_Day Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6.175 ppm, time = 1 min 22 sec	n29715ss	00:01:21	Ref DJP-SS-ethyacetate Group Procter_D
23	Submitted	20251104-1153-B400_B.14-23	10	N H1_Day Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6.175 ppm, time = 1 min 22 sec	n29715ss	00:01:21	Ref DJP-SS-acetoneagain Group Procter_D
24	Submitted	20251104-1159-B400_B.14-24	10	N H1_Day Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6.175 ppm, time = 1 min 22 sec	e72206ov	00:01:21	Ref ov-009.5-f2, 2 Group DeBo_G
25	Submitted	20251104-1159-B400_B.14-25	10	N H1_Day Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6.175 ppm, time = 1 min 22 sec	e72206ov	00:01:21	Ref ov-009.5-f3 Group DeBo_G
26	Submitted	20251104-1200-B400_B.14-26	10	N H1_Day Proton, ns = 16, sw = 20 ppm, centre (o1p) = 6.175 ppm, time = 1 min 22 sec	e72206ov	00:01:21	Ref ov-009.5-f4 Group DeBo_G
27	Submitted	20251104-1204-B400_B.14-27	10	N H1_Quant_NS1_Day Proton experiment, single scan for quantitation, quantitatitive for all samples, time = 30 s	g23544jd	00:00:29	Ref MJJ-JDL-06-003-4h Group James_M
27	Submitted	20251104-1204-B400_B.14-27	11	N F19_Quant_D1_8s_Day Fluorine, ns = 8, sw = 237 ppm, centre (o1p) = -100 ppm, time = 5 min 30 sec, d1 = 8 sec	g23544jd	00:03:14	Ref MJJ-JDL-06-003-4h Group James_M
28	Submitted	20251104-1204-B400_B.14-28	10	N H1_Quant_NS1_Day Proton experiment, single scan for quantitation, quantitatitive for all samples, time = 30 s	g23544jd	00:00:29	Ref MJJ-JDL-06-003-5h Group James_M
28	Submitted	20251104-1204-B400_B.14-28	11	N F19_Quant_D1_8s_Day Fluorine, ns = 8, sw = 237 ppm, centre (o1p) = -100 ppm, time = 5 min 30 sec, d1 = 8 sec	g23544jd	00:03:14	Ref MJJ-JDL-06-003-5h Group James_M
59	Submitted	20251104-0756-B400_B.14-59	12	c H1_NOESY_US_Night NOESY, ns = 4, sw = auto, centre (o1p) = auto, time = 44 min 36 sec	m14269jw	02:09:49	Ref IR-JW-3110-SPC-MB Group Riddell_I
60	Submitted	20251104-0756-B400_B.14-61	12	c H1_NOESY_US_Night NOESY, ns = 4, sw = auto, centre (o1p) = auto, time = 44 min 36 sec	m14269jw	02:09:49	Ref IR-JW-3110-SPC-T Group Riddell_I

History List

Holder	Time	Name	ExpNo	Experiment	User	Load	Atma	Spin	Lock	Shim	Acq	Proc	Title	Remarks
13	12:17:16	20251104-1152-B400_B.14-13	10	H1_Day	n29715ss	-	-	-	-	-	-	-	Ref DJP-SS-originalagain Group Procter_D
12	12:09:24	20251104-1134-B400_B.14-12	10	F19_Quant_D1_8s_Day	z86427mk	+	+	-	+	+	+	+	Ref MK-258-C Group Procter_D	sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0
11	12:02:06	20251104-1134-B400_B.14-11	10	F19_Quant_D1_8s_Day	z86427mk	+	+	-	+	+	+	+	Ref MK-258-B Group Procter_D	sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0
10	11:54:44	20251104-1133-B400_B.14-10	10	F19_Quant_D1_8s_Day	z86427mk	+	+	-	+	+	+	+	Ref MK-258-A Group Procter_D	sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0
9	11:49:59	20251104-1146-B400_B.14-9	10	H1_Day	t13367jb	+	+	-	+	+	+	+	Ref mfg-jb-05-059-c Group Greaney_M mfg-jb-05-059-c
7	11:36:25	20251104-0800-B400_B.14-7	11	H1_Night128	m14269jw	+	+	-	+	+	+	+	Ref IR-JW-3110-SPC-Q Group Riddell_I
9	11:31:35	20251104-1126-B400_B.14-9	10	H1_Day	x73847lm	+	+	-	+	+	+	+	Ref IR-LJM-01-125 F19 Group Riddell_I
6	11:21:44	20251104-0954-B400_B.14-6	10	F19_Quant_D1_8s_Day	c62220rg	+	+	-	+	+	+	+	Ref at-rg-5-29-r1 Group Trowbridge_A	sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0
3	10:08:40	20251104-0953-B400_B.14-3	10	H1_Day	f85241bm	+	+	-	+	+	+	+	Ref BM1007-2 Group Bures_J progress check over night before loading onto silica	Automation was stopped by user
2	10:03:43	20251104-0947-B400_B.14-2	11	F19_Quant_D1_8s_Day	g23544jd	-	+	-	-	-	+	+	Ref MJJ-JDL-06-003-3h Group James_M	sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0
2	09:59:03	20251104-0947-B400_B.14-2	10	H1_Quant_NS1_Day	g23544jd	+	+	-	+	+	+	+	Ref MJJ-JDL-06-003-3h Group James_M
1	09:44:47	20251104-0759-B400_B.14-1	11	H1_Night128	m14269jw	+	+	-	+	+	+	+	Ref IR-JW-3110-SPC-C6 Group Riddell_I
60	09:30:40	20251104-0756-B400_B.14-61	11	H1_Night128	m14269jw	+	+	-	+	+	+	+	Ref IR-JW-3110-SPC-T Group Riddell_I
59	09:16:30	20251104-0756-B400_B.14-59	11	H1_Night128	m14269jw	+	+	-	+	+	+	+	Ref IR-JW-3110-SPC-MB Group Riddell_I
8	09:02:23	20251104-0800-B400_B.14-8	11	H1_Night128	m14269jw	+	+	-	+	+	+	+	Ref IR-JW-3110-SPC-C343 Group Riddell_I
11	08:57:26	20251104-0846-B400_B.14-11	11	F19_Quant_D1_8s_Day	g23544jd	-	+	-	-	-	+	+	Ref MJJ-JDL-06-003- 2 h Group James_M	sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0
11	08:53:01	20251104-0846-B400_B.14-11	10	H1_Quant_NS1_Day	g23544jd	+	+	-	+	+	+	+	Ref MJJ-JDL-06-003- 2 h Group James_M
10	08:47:38	20251104-0843-B400_B.14-10	10	H1_Day	u50028ip	+	+	-	+	+	+	+	Ref Bromo aldehyde Group Larrosa_I
8	08:43:10	20251104-0800-B400_B.14-8	10	H1_Day	m14269jw	+	+	-	+	+	+	+	Ref IR-JW-3110-SPC-C343 Group Riddell_I
7	08:38:56	20251104-0800-B400_B.14-7	10	H1_Day	m14269jw	+	+	-	+	+	+	+	Ref IR-JW-3110-SPC-Q Group Riddell_I
1	08:34:38	20251104-0759-B400_B.14-1	10	H1_Day	m14269jw	+	+	-	+	+	+	+	Ref IR-JW-3110-SPC-C6 Group Riddell_I
60	08:30:09	20251104-0756-B400_B.14-61	10	H1_Day	m14269jw	+	+	-	+	+	+	+	Ref IR-JW-3110-SPC-T Group Riddell_I
59	08:25:07	20251104-0756-B400_B.14-59	10	H1_Day	m14269jw	+	+	-	+	+	+	+	Ref IR-JW-3110-SPC-MB Group Riddell_I
58	08:22:51	20251104-0746-B400_B.14-58	12	P31_CPD_Day	g23544jd	-	+	-	-	-	+	+	Ref MJJ-JDL-06-003- 1 h Group James_M	sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0
58	08:17:52	20251104-0746-B400_B.14-58	11	F19_Quant_D1_8s_Day	g23544jd	-	+	-	-	-	+	+	Ref MJJ-JDL-06-003- 1 h Group James_M	sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0
58	08:13:13	20251104-0746-B400_B.14-58	10	H1_Quant_NS1_Day	g23544jd	+	+	-	+	+	+	+	Ref MJJ-JDL-06-003- 1 h Group James_M
57	08:10:50	20251104-0746-B400_B.14-57	12	P31_CPD_Day	g23544jd	-	+	-	-	-	+	+	Ref MJJ-JDL-06-003- 30 min Group James_M	sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0
57	08:05:22	20251104-0746-B400_B.14-57	11	F19_Quant_D1_8s_Day	g23544jd	-	+	-	-	-	+	+	Ref MJJ-JDL-06-003- 30 min Group James_M	sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0
57	08:00:41	20251104-0746-B400_B.14-57	10	H1_Quant_NS1_Day	g23544jd	+	+	-	+	+	+	+	Ref MJJ-JDL-06-003- 30 min Group James_M
56	07:58:22	20251104-0746-B400_B.14-56	12	P31_CPD_Day	g23544jd	-	+	-	-	-	+	+	Ref MJJ-JDL-06-003- 15 min Group James_M	sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0
56	07:52:46	20251104-0746-B400_B.14-56	11	F19_Quant_D1_8s_Day	g23544jd	-	+	-	-	-	+	+	Ref MJJ-JDL-06-003- 15 min Group James_M	sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0
56	07:47:57	20251104-0746-B400_B.14-56	10	H1_Quant_NS1_Day	g23544jd	+	+	-	+	+	+	+	Ref MJJ-JDL-06-003- 15 min Group James_M
43	05:50:48	20251103-2003-B400_B.14-43	10	H1_Wide_Night	q06880yg	+	+	-	+	+	+	+	Ref stl-yg-030-c6d6-small scale Group Liddle_S
8	05:46:28	20251103-1956-B400_B.14-8	10	H1_Day	z16689fe	+	+	-	+	+	+	+	Ref DJP FE 071 (crude) Group Procter_D
7	05:41:29	20251103-1956-B400_B.14-7	10	H1_Day	z16689fe	+	+	-	+	+	+	+	Ref DJP FE 070 (crude) Group Procter_D
6	05:36:05	20251103-1955-B400_B.14-6	10	H1_Day	z16689fe	+	+	-	+	+	+	+	Ref DJP FE 072 (SM) Group Procter_D
33	05:12:24	20251103-1459-B400_B.14-33	10	H1_Quant_d1_56s_Night	r60833in	+	+	-	+	+	+	+	Ref E Group Cobb_S
32	04:48:44	20251103-1459-B400_B.14-32	10	H1_Quant_d1_56s_Night	r60833in	+	+	-	+	+	+	+	Ref D Group Cobb_S
31	04:25:07	20251103-1459-B400_B.14-31	10	H1_Quant_d1_56s_Night	r60833in	+	+	-	+	+	+	+	Ref C Group Cobb_S
30	04:00:39	20251103-1459-B400_B.14-30	10	H1_Quant_d1_56s_Night	r60833in	+	+	-	+	+	+	+	Ref B Group Cobb_S
29	03:56:33	20251103-1459-B400_B.14-29	10	H1_Quant_d1_56s_Night	r60833in	+	-	-	-	-	-	-	Ref A Group Cobb_S
54	03:08:50	20251103-1422-B400_B.14-54	11	H1_NOESY_US_Night	x73847lm	+	+	-	+	+	+	+	Ref IR-LJM-01-120B Group Riddell_I	xauw: Compiling AU program 'proc_2dhom' Please wait, Compilation finished; proc_2dhom: Compiling AU program 'calcphhomo' Please wait, Compilation finished, xauw: Compiling AU program 'proc_2dhom' Please wait, Compilation finished; proc_2dhom: Compiling AU program 'calcphhomo' Please wait, Compilation finished
1	02:56:31	20251103-1221-B400_B.14-1	17	H1_C13_HSQC_US_Night	a76294rm	-	+	-	-	-	+	+	Ref REM-Lu0.5P4-2D Group Goodwin_C
1	02:35:39	20251103-1221-B400_B.14-1	16	H1_C13_HMBC_US_Night	a76294rm	+	+	-	+	+	+	+	Ref REM-Lu0.5P4-2D Group Goodwin_C
28	02:11:59	20251031-1759-B400_B.14-28	10	H1_Quant_d1_56s_Night	m56482jm	+	+	-	+	+	+	+	Ref SB 05 Group Cobb_S
27	01:48:20	20251031-1757-B400_B.14-27	10	H1_Quant_d1_56s_Night	m56482jm	+	+	-	+	+	+	+	Ref SB 02 Group Cobb_S
26	01:24:39	20251031-1755-B400_B.14-26	10	H1_Quant_d1_56s_Night	m56482jm	+	+	-	+	+	+	+	Ref SB BLANK Group Cobb_S
25	01:00:07	20251031-1754-B400_B.14-25	10	H1_Quant_d1_56s_Night	m56482jm	+	+	-	+	+	+	+	Ref JAM007 Group Cobb_S
24	00:35:39	20251031-1753-B400_B.14-24	10	H1_Quant_d1_56s_Night	m56482jm	+	+	-	+	+	+	+	Ref JAM006 Group Cobb_S
23	00:11:14	20251031-1753-B400_B.14-23	10	H1_Quant_d1_56s_Night	m56482jm	+	+	-	+	+	+	+	Ref JAM005 Group Cobb_S
22	23:46:46	20251031-1752-B400_B.14-22	10	H1_Quant_d1_56s_Night	m56482jm	+	+	-	+	+	+	+	Ref JAM004 Group Cobb_S
21	23:22:01	20251031-1751-B400_B.14-21	10	H1_Quant_d1_56s_Night	m56482jm	+	+	-	+	+	+	+	Ref JAM003 Group Cobb_S
20	22:56:46	20251031-1750-B400_B.14-20	10	H1_Quant_d1_56s_Night	m56482jm	+	+	-	+	+	+	+	Ref JAM002 Group Cobb_S
19	22:31:59	20251031-1748-B400_B.14-19	10	H1_Quant_d1_56s_Night	m56482jm	+	+	-	+	+	+	+	Ref JAM001 Group Cobb_S
42	21:03:02	20251031-1118-B400_B.14-42	10	F19_CPD_Night_1024	mbdxkrn2	+	+	-	+	+	+	+	Ref GDB-RN1578-2 480min sonication MeOH-washed polymer - C6D6 Group DeBo_G	sref: NUCLEUS '19F' not defined for SOLVENT 'C6D6' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'C6D6' SR is set to 0.0
41	19:33:39	20251031-1118-B400_B.14-41	10	F19_CPD_Night_1024	mbdxkrn2	+	+	-	+	+	+	+	Ref GDB-RN1578-1 480min sonication MeOH-washed polymer - C6D6 Group DeBo_G	sref: NUCLEUS '19F' not defined for SOLVENT 'C6D6' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'C6D6' SR is set to 0.0
4	18:50:06	20251031-0844-B400_B.14-4	11	Si29_DEPT90_Night	p69506xd	+	x	-	-	-	-	-	Ref STL-XLD-Th(COTii)2-after sublimation-KOtBu Group Liddle_S	ATM Failed
17	18:41:01	20251031-1721-B400_B.14-17	11	H1_Day	z40241jm	+	+	-	+	+	+	+	Ref DJP-JIM-7-137-2a Group Procter_D
16	18:36:00	20251103-1831-B400_B.14-16	10	H1_Day	g16660ml	+	+	-	+	+	+	+	Ref djp-muze-2 Group Procter_D
15	18:31:36	20251103-1831-B400_B.14-15	10	H1_Day	g16660ml	+	+	-	+	+	+	+	Ref djp-muze-1 Group Procter_D
14	18:01:48	20251103-1727-B400_B.14-14	10	F19_CPD_Night	g23544jd	+	+	-	+	+	+	+	Ref MJJ-JDL-069-3-P Group James_M	sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0
16	17:57:57	20251103-1727-B400_B.14-16	10	H1_Day	g23544jd	+	+	-	+	+	+	+	Ref MJJ-JDL-5B-040-P Group James_M
15	17:53:51	20251103-1727-B400_B.14-15	10	H1_Day	g23544jd	+	+	-	+	+	+	+	Ref MJJ-JDL-5B-039-P Group James_M
13	17:47:58	20251103-1704-B400_B.14-13	10	H1_Day	y27382tp	+	+	-	+	+	+	+	Ref MIG_TP003 t=3 crude Group Other
11	17:42:51	20251103-1651-B400_B.14-11	10	H1_Day	j40457bh	+	+	-	+	+	+	+	Ref bh 4-270 c1s1 Group Trowbridge_A
10	17:37:52	20251103-1651-B400_B.14-10	10	H1_Day	j40457bh	+	+	-	+	+	+	+	Ref bh ah 144 Group Trowbridge_A
8	17:32:53	20251103-1623-B400_B.14-8	11	F19_Quant_D1_8s_Day	u50028ip	-	+	-	-	-	+	+	Ref ANtracene koac Group Larrosa_I	sref: reference peak outside file limits default calibration done, sref: reference peak outside file limits default calibration done
8	17:28:42	20251103-1623-B400_B.14-8	10	H1_Day	u50028ip	+	+	-	+	+	+	+	Ref ANtracene koac Group Larrosa_I
7	17:23:48	20251103-1623-B400_B.14-7	11	F19_Quant_D1_8s_Day	u50028ip	-	+	-	-	-	+	+	Ref ANtracene A Group Larrosa_I	sref: reference peak outside file limits default calibration done, sref: reference peak outside file limits default calibration done
7	17:19:29	20251103-1623-B400_B.14-7	10	H1_Day	u50028ip	+	+	-	+	+	+	+	Ref ANtracene A Group Larrosa_I
6	17:14:32	20251103-1623-B400_B.14-6	11	F19_Quant_D1_8s_Day	u50028ip	-	+	-	-	-	+	+	Ref Gllu salt Group Larrosa_I	sref: reference peak outside file limits default calibration done, sref: reference peak outside file limits default calibration done
6	17:09:57	20251103-1623-B400_B.14-6	10	H1_Day	u50028ip	+	+	-	+	+	+	+	Ref Gllu salt Group Larrosa_I
2	17:05:10	20251103-1648-B400_B.14-2	10	H1_Day	g16660ml	+	+	-	+	+	+	+	Ref djp-muze Group Procter_D
60	16:59:44	20251103-1638-B400_B.14-60	10	H1_Day	p10102hz	+	+	-	+	+	+	+	Ref zhb-a-121s Group Procter_D
59	16:55:03	20251103-1626-B400_B.14-59	10	H1_Day	b26045ab	+	+	-	+	+	+	+	Ref AT-ABO-02-BHAH42-P1 Group Trowbridge_A
58	16:50:08	20251103-1625-B400_B.14-58	11	F19_Quant_D1_8s_Day	u50028ip	-	+	-	-	-	+	+	Ref Antracene complex B Group Larrosa_I	sref: reference peak outside file limits default calibration done, sref: reference peak outside file limits default calibration done
58	16:45:49	20251103-1625-B400_B.14-58	10	H1_Day	u50028ip	+	+	-	+	+	+	+	Ref Antracene complex B Group Larrosa_I
57	16:40:50	20251103-1625-B400_B.14-57	11	F19_Quant_D1_8s_Day	u50028ip	-	+	-	-	-	+	+	Ref antracene complex Cs2CO3 Group Larrosa_I	sref: reference peak outside file limits default calibration done, sref: reference peak outside file limits default calibration done
57	16:36:41	20251103-1625-B400_B.14-57	10	H1_Day	u50028ip	+	+	-	+	+	+	+	Ref antracene complex Cs2CO3 Group Larrosa_I
56	16:30:20	20251103-1621-B400_B.14-56	11	F19_Quant_D1_8s_Day	u50028ip	-	+	-	-	-	+	+	Ref Urea quinoline first frac Group Larrosa_I	sref: NUCLEUS '19F' not defined for SOLVENT 'DMSO' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'DMSO' SR is set to 0.0
56	16:26:13	20251103-1621-B400_B.14-56	10	H1_Day	u50028ip	+	+	-	+	+	+	+	Ref Urea quinoline first frac Group Larrosa_I
55	16:21:39	20251103-1621-B400_B.14-55	10	H1_Day	u50028ip	+	+	-	+	+	+	+	Ref Br aldehyde Group Larrosa_I
44	16:14:44	20251031-1823-B400_B.14-44	11	C13_CPD_Night256	g23544jd	-	-	-	-	-	-	-	Ref MJJ-JDL-06-000-CF3 Pip Group James_M
1	16:10:13	20251103-1221-B400_B.14-1	15	H1_Night	a76294rm	+	+	-	+	+	+	+	Ref REM-Lu0.5P4-2D Group Goodwin_C
2	16:05:00	20251103-1601-B400_B.14-2	10	H1_Day	g16660ml	+	+	-	+	+	+	+	Ref djp-muze Group Procter_D
1	15:51:04	20251103-1221-B400_B.14-1	14	H1_COSY_HiRes_Night	a76294rm	+	+	-	+	+	+	+	Ref REM-Lu0.5P4-2D Group Goodwin_C
54	15:46:09	20251103-1422-B400_B.14-54	10	H1_Night	x73847lm	+	+	-	+	+	+	+	Ref IR-LJM-01-120B Group Riddell_I
53	15:34:24	20251103-1357-B400_B.14-53	12	H1_COSY_HiRes_Night	q17816aj	-	+	-	-	-	+	+	Ref IR-AJ-010(13)_pure Group Riddell_I
53	15:17:19	20251103-1357-B400_B.14-53	11	C13_CPD_Night256	q17816aj	+	+	-	+	+	+	+	Ref IR-AJ-010(13)_pure Group Riddell_I	sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
8	15:12:38	20251103-1502-B400_B.14-8	10	H1_Day	d93111sd	+	+	-	+	+	+	+	Ref IL-SD-9A Group Larrosa_I
53	14:58:04	20251103-1357-B400_B.14-53	10	H1_Night128	q17816aj	+	+	-	+	+	+	+	Ref IR-AJ-010(13)_pure Group Riddell_I
3	14:53:22	20251103-1354-B400_B.14-3	10	H1_Day	y27382tp	+	+	-	+	+	+	+	Ref MIG_TP003 t=0 Group Other
55	14:48:30	20251103-1432-B400_B.14-55	10	H1_Day	b26045ab	+	+	-	+	+	+	+	Ref AT-ABO-02-549-P1 Group Trowbridge_A
51	14:45:52	20251103-1347-B400_B.14-51	11	Li7_CPD_Day	b90273gm	-	+	-	-	-	+	+	Ref GM18_Sc1B Group Liddle_S 1st crop, orange solid, ScR3	sref: NUCLEUS '7Li' not defined for SOLVENT 'C6D6' SR is set to 0.0, sref: NUCLEUS '7Li' not defined for SOLVENT 'C6D6' SR is set to 0.0
51	14:41:42	20251103-1347-B400_B.14-51	10	H1_Day	b90273gm	+	+	-	+	+	+	+	Ref GM18_Sc1B Group Liddle_S 1st crop, orange solid, ScR3
50	14:36:35	20251103-1341-B400_B.14-47	10	H1_Day	p10102hz	+	+	-	+	+	+	+	Ref zhb-a-121v Group Procter_D
49	14:30:31	20251103-1115-B400_B.14-49	12	H1_WaterSupp_Day	p98722sl	+	+	-	+	+	+	+	Ref SL-SC-03 Group Cobb_S
48	14:24:20	20251103-1114-B400_B.14-48	12	H1_WaterSupp_Day	p98722sl	+	+	-	+	+	+	+	Ref SL-SC-02 Group Cobb_S
47	14:17:18	20251103-1114-B400_B.14-47	12	H1_WaterSupp_Day	p98722sl	+	+	-	+	+	+	+	Ref SL-SC-01 Group Cobb_S
46	14:12:57	20251103-1341-B400_B.14-46	10	H1_Day	p10102hz	+	+	-	+	+	+	+	Ref zhb-a-121u Group Procter_D
45	14:07:21	20251103-1341-B400_B.14-45	10	H1_Day	p10102hz	+	+	-	+	+	+	+	Ref zhb-a-121t Group Procter_D
43	14:02:19	20251103-1339-B400_B.14-43	10	H1_Day	g16660ml	+	+	-	+	+	+	+	Ref djp-muze Group Procter_D
40	13:55:58	20251103-1207-B400_B.14-40	11	H1_WaterSupp_Day	p98722sl	+	+	-	+	+	+	+	Ref SL-SC-05 Group Cobb_S
39	13:49:36	20251031-1059-B400_B.14-39	12	H1_WaterSupp_Day	p98722sl	+	+	-	+	+	+	+	Ref SL-SC-04 Group Cobb_S
38	13:43:33	20251031-1059-B400_B.14-38	12	H1_WaterSupp_Day	p98722sl	+	+	-	+	+	+	+	Ref SL-SC-03 Group Cobb_S
37	13:37:33	20251031-1059-B400_B.14-37	12	H1_WaterSupp_Day	p98722sl	+	+	-	+	+	+	+	Ref SL-SC-02 Group Cobb_S
36	13:29:32	20251031-1058-B400_B.14-36	12	H1_WaterSupp_Day	p98722sl	+	+	-	+	+	+	+	Ref SL-SC-01 Group Cobb_S
5	13:26:19	20251031-1317-B400_B.14-5	12	H1_Day	d93111sd	+	+	-	+	-	+	+	Ref IL-SD-9 Group Larrosa_I	pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Larrosa_I/data/d93111sd/nmr/20251031-1317-B400_B.14-5/12/pdata/1/peaks!, pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Larrosa_I/data/d93111sd/nmr/20251031-1317-B400_B.14-5/12/pdata/1/peaks!
2	13:21:52	20251103-1300-B400_B.14-2	10	H1_Day	b26045ab	+	+	-	+	+	+	+	Ref AT-ABO-02-545-iso Group Trowbridge_A
1	13:19:47	20251103-1221-B400_B.14-1	13	P31_CPD_Day	a76294rm	-	+	-	-	-	+	+	Ref REM-Lu0.5P4-2D Group Goodwin_C	sref: reference peak outside file limits default calibration done; pp: Cannot find any peak for scaling in /mnt/nmrdata/Goodwin_C/data/a76294rm/nmr/20251103-1221-B400_B.14-1/13/pdata/1/peaks!, sref: reference peak outside file limits default calibration done; pp: Cannot find any peak for scaling in /mnt/nmrdata/Goodwin_C/data/a76294rm/nmr/20251103-1221-B400_B.14-1/13/pdata/1/peaks!
1	13:17:34	20251103-1221-B400_B.14-1	12	P31_CPD_Day	a76294rm	-	+	-	-	-	+	+	Ref REM-Lu0.5P4-2D Group Goodwin_C	sref: reference peak outside file limits default calibration done; pp: Cannot find any peak for scaling in /mnt/nmrdata/Goodwin_C/data/a76294rm/nmr/20251103-1221-B400_B.14-1/12/pdata/1/peaks!, sref: reference peak outside file limits default calibration done; pp: Cannot find any peak for scaling in /mnt/nmrdata/Goodwin_C/data/a76294rm/nmr/20251103-1221-B400_B.14-1/12/pdata/1/peaks!
1	13:15:11	20251103-1221-B400_B.14-1	11	P31_CPD_Day	a76294rm	-	+	-	-	-	+	+	Ref REM-Lu0.5P4-2D Group Goodwin_C	sref: reference peak outside file limits default calibration done; pp: Cannot find any peak for scaling in /mnt/nmrdata/Goodwin_C/data/a76294rm/nmr/20251103-1221-B400_B.14-1/11/pdata/1/peaks!, sref: reference peak outside file limits default calibration done; pp: Cannot find any peak for scaling in /mnt/nmrdata/Goodwin_C/data/a76294rm/nmr/20251103-1221-B400_B.14-1/11/pdata/1/peaks!
1	13:09:32	20251103-1221-B400_B.14-1	10	H1_Wide_Day	a76294rm	+	+	-	+	+	+	+	Ref REM-Lu0.5P4-2D Group Goodwin_C
60	13:03:28	20251103-1202-B400_B.14-60	11	H1_WaterSupp_Day	p98722sl	+	+	-	+	+	+	+	Ref SL-SC-08 Group Cobb_S
59	12:57:23	20251103-1201-B400_B.14-59	11	H1_WaterSupp_Day	p98722sl	+	+	-	+	+	+	+	Ref SL-SC-07 Group Cobb_S
58	12:50:12	20251103-1201-B400_B.14-58	11	H1_WaterSupp_Day	p98722sl	+	+	-	+	+	+	+	Ref SL-SC-06 Group Cobb_S
57	12:42:18	20251103-1201-B400_B.14-57	11	H1_WaterSupp_Day	p98722sl	+	+	-	+	+	+	+	Ref SL-SC-05 Group Cobb_S
55	12:37:14	20251103-1228-B400_B.14-55	10	H1_Day	e72206ov	+	+	-	+	+	+	+	Ref ov-009.5-solidifiued remanentstest Group DeBo_G
54	12:32:21	20251103-1218-B400_B.14-54	10	H1_Day	w52164bc	+	+	-	+	+	+	+	Ref BC-11-145 F75-88 Group James_M
53	12:27:57	20251103-1218-B400_B.14-53	10	H1_Day	w52164bc	+	+	-	+	+	+	+	Ref BC-11-145 F63-74 Group James_M
51	12:23:06	20251103-1209-B400_B.14-51	10	F19_CPD_Day	j82494jb	+	+	-	+	+	+	+	Ref QBB-Rot_HPLC_peak_1 Group Leigh_D	sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0
50	12:18:54	20251103-1118-B400_B.14-50	13	H1_WaterSupp_Day	p98722sl	-	+	-	-	-	+	+	Ref SL-SC-04 Group Cobb_S
50	12:14:16	20251103-1118-B400_B.14-50	12	H1_Quant_NS1_Day	p98722sl	+	+	-	+	+	+	+	Ref SL-SC-04 Group Cobb_S
48	12:09:44	20251103-1114-B400_B.14-48	11	H1_Quant_NS1_Day	p98722sl	+	+	-	+	+	+	+	Ref SL-SC-02 Group Cobb_S
47	12:03:58	20251103-1114-B400_B.14-47	11	H1_Quant_NS1_Day	p98722sl	+	+	-	+	+	+	+	Ref SL-SC-01 Group Cobb_S
1	11:59:20	20251103-1107-B400_B.14-1	10	H1_Day	y27382tp	+	+	-	+	+	+	+	Ref MIG_TP002 Purified product Group Other
54	11:56:40	20251103-1144-B400_B.14-54	11	Li7_CPD_Day	b90273gm	-	+	-	-	-	+	+	Ref GM18_Sc1 Group Liddle_S Orange solid, first crop, ScR3	sref: NUCLEUS '7Li' not defined for SOLVENT 'C6D6' SR is set to 0.0; pp: Cannot find any peak for scaling in /mnt/nmrdata/Liddle_S/data/b90273gm/nmr/20251103-1144-B400_B.14-54/11/pdata/1/peaks!, sref: NUCLEUS '7Li' not defined for SOLVENT 'C6D6' SR is set to 0.0; pp: Cannot find any peak for scaling in /mnt/nmrdata/Liddle_S/data/b90273gm/nmr/20251103-1144-B400_B.14-54/11/pdata/1/peaks!
54	11:52:25	20251103-1144-B400_B.14-54	10	H1_Day	b90273gm	+	+	-	+	+	+	+	Ref GM18_Sc1 Group Liddle_S Orange solid, first crop, ScR3
53	11:47:55	20251103-1136-B400_B.14-53	10	F19_CPD_Day	j82494jb	+	+	-	+	+	+	+	Ref QBB_Rot_HPLC_peak2 Group Leigh_D	sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0
51	11:43:29	20251103-1123-B400_B.14-51	10	H1_Quant_NS1_Day	g23544jd	+	+	-	+	+	+	+	Ref MJJ-JDL-05-068-5-1h Group James_M
50	11:37:10	20251103-1118-B400_B.14-50	11	H1_COSY_Day	mbdxrbj2	-	+	-	-	-	+	+	Ref BJ671_2D Group Procter_D
50	11:32:42	20251103-1118-B400_B.14-50	10	H1_Day	mbdxrbj2	+	+	-	+	+	+	+	Ref BJ671_2D Group Procter_D
49	11:28:08	20251103-1115-B400_B.14-49	10	H1_Day	j40457bh	+	+	-	+	+	+	+	Ref bh ah c1 s3 Group Trowbridge_A
48	11:23:53	20251103-1114-B400_B.14-48	10	H1_Day	j40457bh	+	+	-	+	+	+	+	Ref bh ah 148 c1 s2 Group Trowbridge_A
47	11:19:04	20251103-1114-B400_B.14-47	10	H1_Day	j40457bh	+	+	-	+	+	+	+	Ref bh ah 148 c1 s1 Group Trowbridge_A
46	11:14:43	20251103-1114-B400_B.14-46	10	H1_Day	z86427mk	+	+	-	+	+	+	+	Ref MK-DMSO Group Procter_D
45	11:10:16	20251103-1101-B400_B.14-45	10	H1_Day	m52750pm	+	+	-	+	+	+	+	Ref GCPM165cr Group Crisenza_G
44	11:05:39	20251031-1823-B400_B.14-44	10	H1_Day	g23544jd	+	+	-	+	+	+	+	Ref MJJ-JDL-06-000-CF3 Pip Group James_M
43	11:01:58	20251031-1822-B400_B.14-43	10	H1_Quant_NS1_Day	g23544jd	+	+	-	+	+	+	+	Ref MJJ-JDL-5B-041-5 Group James_M
35	10:57:53	20251031-1822-B400_B.14-35	10	H1_Quant_NS1_Day	g23544jd	+	+	-	+	+	+	+	Ref MJJ-JDL-5B-041-4 Group James_M
32	10:53:32	20251103-1028-B400_B.14-32	10	H1_Day	j20588jh	+	+	-	+	+	+	+	Ref JH-DW-40.01.1-DippN3 Group Willcox_D Oil, 1-5
31	10:50:09	20251031-1820-B400_B.14-31	10	H1_Quant_NS1_Day	g23544jd	+	+	-	+	+	+	+	Ref MJJ-JDL-5B-041-3 Group James_M
30	10:46:18	20251031-1820-B400_B.14-30	10	H1_Quant_NS1_Day	g23544jd	+	+	-	+	+	+	+	Ref MJJ-JDL-5B-041-2 Group James_M
29	10:42:23	20251031-1820-B400_B.14-29	10	H1_Quant_NS1_Day	g23544jd	+	+	-	+	+	+	+	Ref MJJ-JDL-5B-041-1 Group James_M
18	10:42:06	20251031-1734-B400_B.14-18	10	H1_Day	z65435tw	x	-	-	-	-	-	-	Ref tw-1198-c-1h-cdcl3 Group Crisenza_G	WebService Error: 103.310.145:Sample Missing Error:No sample found with Position or Tube ID '1.18'.
17	10:27:03	20251031-1721-B400_B.14-17	10	H1_Day	c15204fs	+	x	-	-	-	-	-	Ref GDB-FS004C Group DeBo_G	ATM Failed
16	17:37:27	20251031-1720-B400_B.14-16	10	H1_Day	c15204fs	-	-	-	-	-	-	-	Ref GDB-FS004Fr5 Group DeBo_G
15	17:33:22	20251031-1720-B400_B.14-15	10	H1_Day	c15204fs	+	+	-	+	+	+	+	Ref GDB-FS004Fr15 Group DeBo_G
14	17:29:01	20251031-1720-B400_B.14-14	10	H1_Day	c15204fs	+	+	-	+	+	+	+	Ref GDB-FS004Fr29 Group DeBo_G
13	17:24:05	20251031-1657-B400_B.14-13	10	H1_Day	w52164bc	+	+	-	+	+	+	+	Ref BC-11-150 Group James_M
11	17:21:49	20251031-1657-B400_B.14-11	11	F19_CPD_Day	w52164bc	-	+	-	-	-	+	+	Ref BC-11-145 P2 Group James_M	sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0
11	17:17:18	20251031-1657-B400_B.14-11	10	H1_Day	w52164bc	+	+	-	+	+	+	+	Ref BC-11-145 P2 Group James_M
10	17:14:05	20251031-1657-B400_B.14-10	11	F19_CPD_Day	w52164bc	-	+	-	-	-	+	+	Ref BC-11-145 P1 Group James_M	sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0
10	17:09:30	20251031-1657-B400_B.14-10	10	H1_Day	w52164bc	+	+	-	+	+	+	+	Ref BC-11-145 P1 Group James_M
8	17:07:38	20251031-1656-B400_B.14-8	11	F19_NoCPD_Day	mbdxrbj2	-	+	-	-	-	+	+	Ref BJ672 Group Procter_D	sref: reference peak outside file limits default calibration done, sref: reference peak outside file limits default calibration done
8	17:03:35	20251031-1656-B400_B.14-8	10	H1_Day	mbdxrbj2	+	+	-	+	+	+	+	Ref BJ672 Group Procter_D
7	17:00:58	20251031-1656-B400_B.14-7	11	F19_NoCPD_Day	mbdxrbj2	-	+	-	-	-	+	+	Ref BJ671_PC Group Procter_D	sref: reference peak outside file limits default calibration done, sref: reference peak outside file limits default calibration done
7	16:56:40	20251031-1656-B400_B.14-7	10	H1_Day	mbdxrbj2	+	+	-	+	+	+	+	Ref BJ671_PC Group Procter_D
6	16:50:25	20251031-1649-B400_B.14-6	10	P31_CPD_Day	z40241jm	+	+	-	+	+	+	+	Ref DJP-JIM-7-136-0-recrystalisedP(cyHex)3 Group Procter_D	sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0
60	16:42:25	20251031-1640-B400_B.14-60	10	H1_Day	b26045ab	+	+	-	+	+	+	+	Ref AT-ABO-02-550-cr Group Trowbridge_A
59	16:38:12	20251031-1624-B400_B.14-59	10	H1_Day	d93111sd	+	+	-	+	+	+	+	Ref IL-SD-7B Group Larrosa_I
46	16:33:42	20251031-1616-B400_B.14-46	10	H1_Day	h91839em	+	+	-	+	+	+	+	Ref GC EM 154 Group Crisenza_G
45	16:28:54	20251031-1607-B400_B.14-45	10	H1_Day	a15978el	+	+	-	+	+	+	+	Ref EL-04-065 e Group James_M
44	16:17:09	20251031-1518-B400_B.14-44	10	H1_Quant_D1_25s_Day	s52134ad	+	+	-	+	+	+	+	Ref AJD J45 SM (A2) Group Larrosa_I
43	16:14:58	20251031-1606-B400_B.14-43	11	F19_NoCPD_Day	a15978el	-	+	-	-	-	+	+	Ref EL-04-060 f29-43 Group James_M	sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0
43	16:09:27	20251031-1606-B400_B.14-43	10	H1_Day	a15978el	+	+	-	+	+	+	+	Ref EL-04-060 f29-43 Group James_M
35	16:03:55	20251031-1534-B400_B.14-35	10	H1_Day	n06287cb	+	+	-	+	+	+	+	Ref IL-CB-949c Group Larrosa_I
34	15:59:42	20251031-1558-B400_B.14-34	10	H1_Day	z88883sp	+	+	-	+	+	+	+	Ref CCK_Et2LAu(B^N^O) Group Romanov_A
33	15:48:17	20251031-1517-B400_B.14-33	10	H1_Quant_D1_25s_Day	s52134ad	+	+	-	+	+	+	+	Ref AJD J44 SM (A1) Group Larrosa_I
33	15:41:16	20251031-1517-B400_B.14-33	10	H1_Quant_D1_25s_Day	s52134ad	-	-	-	-	-	-	-	Ref AJD J44 SM (A1) Group Larrosa_I
34	15:35:57	20251031-1533-B400_B.14-34	10	H1_Day	r25963ar	+	+	-	+	+	+	+	Ref Et2CAAC_AuBG Group Romanov_A Et2CAAC_AuBG
32	15:31:21	20251031-1515-B400_B.14-32	10	H1_Day	g23544jd	+	+	-	+	+	+	+	Ref JDL-rotavp 2 Group James_M
31	15:26:49	20251031-1508-B400_B.14-31	10	P31_CPD_Day	z40241jm	+	+	-	+	+	+	+	Ref DJP-JIM-7-130-CAS:91608-15-0-EtOHrecryst Group Procter_D	sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0
30	15:21:37	20251031-1502-B400_B.14-30	10	H1_Day	j40457bh	+	+	-	+	+	+	+	Ref bhah 146 c1 rest Group Trowbridge_A
29	15:16:37	20251031-1501-B400_B.14-29	10	H1_Day	j40457bh	+	+	-	+	+	+	+	Ref bhah145 c1 rest Group Trowbridge_A
28	15:12:07	20251031-1430-B400_B.14-28	10	H1_Day	y83900an	+	+	-	+	+	+	+	Ref IL-AMN-05-052-Column Group Larrosa_I
27	15:07:39	20251031-1419-B400_B.14-27	10	H1_Day	b32507dt	+	+	-	+	+	+	+	Ref dtgb 137 fin Group Webb_S
26	15:03:21	20251031-1419-B400_B.14-26	10	H1_Day	b32507dt	+	+	-	+	+	+	+	Ref dtgb 137 17 Group Webb_S
25	14:59:04	20251031-1419-B400_B.14-25	10	H1_Day	b32507dt	+	+	-	+	+	+	+	Ref dtgb 134 18 Group Webb_S
24	14:54:26	20251031-1419-B400_B.14-24	10	H1_Day	b32507dt	+	+	-	+	+	+	+	Ref dtgb 134 fin Group Webb_S
23	14:45:22	20251031-1343-B400_B.14-23	10	F19_Quant_D1_8s_Day	z86427mk	+	+	-	+	+	+	+	Ref MK-257-D Group Procter_D	sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0
22	14:40:45	20251031-1355-B400_B.14-22	10	F19_CPD_Day	mbdxkrn2	+	+	-	+	+	+	+	Ref GDB-RN1591 Mixture after 2h - Acetone-d6 Group DeBo_G	sref: reference peak outside file limits default calibration done, sref: reference peak outside file limits default calibration done
21	14:38:13	20251031-1355-B400_B.14-21	11	F19_CPD_Day	mbdxkrn2	-	+	-	-	-	+	+	Ref GDB-RN1592 Prep Main Band - Acetone-d6 Group DeBo_G	sref: reference peak outside file limits default calibration done, sref: reference peak outside file limits default calibration done
21	14:33:48	20251031-1355-B400_B.14-21	10	H1_Day	mbdxkrn2	+	+	-	+	+	+	+	Ref GDB-RN1592 Prep Main Band - Acetone-d6 Group DeBo_G
20	14:27:24	20251031-1343-B400_B.14-20	10	F19_Quant_D1_8s_Day	z86427mk	+	+	-	+	+	+	+	Ref MK-257-C Group Procter_D	sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0
19	14:20:02	20251031-1343-B400_B.14-19	10	F19_Quant_D1_8s_Day	z86427mk	+	+	-	+	+	+	+	Ref MK-257-B Group Procter_D	sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0
18	14:13:14	20251031-1342-B400_B.14-18	10	F19_Quant_D1_8s_Day	z86427mk	+	+	-	+	+	+	+	Ref MK-257-A Group Procter_D	sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0
17	14:08:17	20251031-1340-B400_B.14-17	10	H1_Day	n29715ss	+	+	-	+	+	+	+	Ref DJP-SS-24 Group Procter_D
16	14:02:01	20251031-1322-B400_B.14-16	11	H1_COSY_Day	g51050xx	-	+	-	-	-	+	+	Ref xxt-18-4 Group Gardiner_J
16	13:57:33	20251031-1322-B400_B.14-16	10	H1_Day	g51050xx	+	+	-	+	+	+	+	Ref xxt-18-4 Group Gardiner_J
15	13:51:17	20251031-1322-B400_B.14-15	11	H1_COSY_Day	g51050xx	-	+	-	-	-	+	+	Ref xxt-18-3 Group Gardiner_J
15	13:47:01	20251031-1322-B400_B.14-15	10	H1_Day	g51050xx	+	+	-	+	+	+	+	Ref xxt-18-3 Group Gardiner_J
14	13:40:47	20251031-1322-B400_B.14-14	11	H1_COSY_Day	g51050xx	-	+	-	-	-	+	+	Ref xxt-18-2 Group Gardiner_J
14	13:36:19	20251031-1322-B400_B.14-14	10	H1_Day	g51050xx	+	+	-	+	+	+	+	Ref xxt-18-2 Group Gardiner_J
13	13:30:02	20251031-1322-B400_B.14-13	11	H1_COSY_Day	g51050xx	-	+	-	-	-	+	+	Ref xxt-18-1 Group Gardiner_J
13	13:24:59	20251031-1322-B400_B.14-13	10	H1_Day	g51050xx	+	+	-	+	+	+	+	Ref xxt-18-1 Group Gardiner_J
5	13:23:44	20251031-1317-B400_B.14-5	11	B10_CPD_broad_Day	mbdxkrn2	-	-	-	-	-	-	-	Ref GDB-RN1591 Mixture after 24h - Acetone-d6 Group DeBo_G
5	13:18:28	20251031-1317-B400_B.14-5	10	H1_Day	mbdxkrn2	+	+	-	+	+	+	+	Ref GDB-RN1591 Mixture after 24h - Acetone-d6 Group DeBo_G
3	13:14:17	20251031-1308-B400_B.14-3	10	P31_CPD_Day	z40241jm	+	+	-	+	+	+	+	Ref DJP-JIM-7-130-CAS:91608-15-0-Trowbridge2 Group Procter_D	sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0
2	13:09:47	20251031-1308-B400_B.14-2	10	P31_CPD_Day	z40241jm	+	+	-	+	+	+	+	Ref DJP-JIM-7-130-CAS:91608-15-0-Trowbridge1 Group Procter_D	sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0
51	12:37:09	20251031-1219-B400_B.14-51	10	H1_Day	g23544jd	+	+	-	+	+	+	+	Ref MJJ-JDL-Rotav Group James_M
48	12:33:38	20251030-1015-B400_B.14-48	11	Al27_Day	j20588jh	+	+	-	+	+	+	+	Ref JH-DW-26.08.5-DippZnAlCl TMSN3 Group Willcox_D Hex crys	sref: NUCLEUS '27Al' not defined for SOLVENT 'C6D6' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Willcox_D/data/j20588jh/nmr/20251030-1015-B400_B.14-48/11/pdata/1/peaks!, sref: NUCLEUS '27Al' not defined for SOLVENT 'C6D6' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Willcox_D/data/j20588jh/nmr/20251030-1015-B400_B.14-48/11/pdata/1/peaks!
47	12:28:53	20251031-1217-B400_B.14-47	10	H1_Day	g23544jd	+	+	-	+	+	+	+	Ref MJJ-JDL-05-072-P Group James_M
46	12:24:34	20251031-1217-B400_B.14-46	10	H1_Day	g23544jd	+	+	-	+	+	+	+	Ref MJJ-JDL-05-071-P Group James_M
45	12:20:06	20251031-1217-B400_B.14-45	10	H1_Quant_NS1_Day	g23544jd	+	+	-	+	+	+	+	Ref MJJ-JDL-05-068-4-x Group James_M
44	12:15:36	20251031-1215-B400_B.14-44	10	H1_Day	h91839em	+	+	-	+	+	+	+	Ref GC EM 154 C Group Crisenza_G
35	11:49:58	20251031-1146-B400_B.14-35	10	H1_Day	z65435tw	+	+	-	+	+	+	+	Ref tw-1197-c-1h-cdcl3 Group Crisenza_G
34	11:45:17	20251031-1140-B400_B.14-34	11	F19_Quant_D1_8s_Day	e03178pd	-	+	-	-	-	+	+	Ref IL-pdl753F Group Larrosa_I	sref: NUCLEUS '19F' not defined for SOLVENT 'C6D6' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'C6D6' SR is set to 0.0
34	11:40:51	20251031-1140-B400_B.14-34	10	H1_Day	e03178pd	+	+	-	+	+	+	+	Ref IL-pdl753F Group Larrosa_I
33	11:28:12	20251031-1115-B400_B.14-33	10	H1_Day	b32507dt	+	+	-	+	+	+	+	Ref dtga 93b Group Webb_S
32	11:23:28	20251031-1115-B400_B.14-32	10	H1_Day	b32507dt	+	+	-	+	+	+	+	Ref dtga 93a Group Webb_S
31	11:18:35	20251031-1057-B400_B.14-31	10	H1_Day	q17816aj	+	+	-	+	+	+	+	Ref IR-AJ-010(13)_trit Group Riddell_I
30	11:15:47	20251031-0954-B400_B.14-30	10	H1_Day	e03178pd	-	-	-	-	-	-	-	Ref IL-pdl753F Group Larrosa_I
29	11:11:02	20251031-0954-B400_B.14-29	11	F19_Quant_D1_8s_Day	e03178pd	-	+	-	-	-	+	+	Ref IL-pdl753E Group Larrosa_I	sref: NUCLEUS '19F' not defined for SOLVENT 'C6D6' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'C6D6' SR is set to 0.0
29	11:06:35	20251031-0954-B400_B.14-29	10	H1_Day	e03178pd	+	+	-	+	+	+	+	Ref IL-pdl753E Group Larrosa_I
28	11:00:42	20251031-0954-B400_B.14-28	11	F19_Quant_D1_8s_Day	e03178pd	-	+	-	-	-	+	+	Ref IL-pdl753D Group Larrosa_I	sref: NUCLEUS '19F' not defined for SOLVENT 'C6D6' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'C6D6' SR is set to 0.0
28	10:55:53	20251031-0954-B400_B.14-28	12	H1_Day	e03178pd	+	+	-	+	+	+	+	Ref IL-pdl753D Group Larrosa_I
25	10:36:30	20251031-1001-B400_B.14-25	11	F19_CPD_Day	w52164bc	-	+	-	-	-	+	+	Ref BC-11-148 P2 Group James_M	sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0
25	10:31:38	20251031-1001-B400_B.14-25	10	H1_Day	w52164bc	+	+	-	+	+	+	+	Ref BC-11-148 P2 Group James_M
24	10:26:51	20251031-0954-B400_B.14-24	11	F19_Quant_D1_8s_Day	e03178pd	-	+	-	-	-	+	+	Ref IL-pdl753C Group Larrosa_I	sref: NUCLEUS '19F' not defined for SOLVENT 'C6D6' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'C6D6' SR is set to 0.0
24	10:21:58	20251031-0954-B400_B.14-24	10	H1_Day	e03178pd	+	+	-	+	+	+	+	Ref IL-pdl753C Group Larrosa_I
23	10:17:08	20251031-0954-B400_B.14-23	11	F19_Quant_D1_8s_Day	e03178pd	-	+	-	-	-	+	+	Ref IL-pdl753B Group Larrosa_I	sref: NUCLEUS '19F' not defined for SOLVENT 'C6D6' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'C6D6' SR is set to 0.0
23	10:08:10	20251031-0954-B400_B.14-23	10	H1_Day	e03178pd	+	+	-	+	x	+	+	Ref IL-pdl753B Group Larrosa_I	topshim: TopshimWaitForEvent - acquisition completed : timeout after 320 sec, Shim failed
22	10:02:30	20251031-0954-B400_B.14-22	11	F19_Quant_D1_8s_Day	e03178pd	-	+	-	-	-	+	+	Ref IL-pdl753A Group Larrosa_I	sref: NUCLEUS '19F' not defined for SOLVENT 'C6D6' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'C6D6' SR is set to 0.0
22	09:57:32	20251031-0954-B400_B.14-22	10	H1_Day	e03178pd	+	+	-	+	+	+	+	Ref IL-pdl753A Group Larrosa_I
7	09:34:30	20251031-0929-B400_B.14-7	10	H1_Day	a15978el	+	+	-	+	+	+	+	Ref EL-04-063 f5-11 Group James_M
6	09:30:08	20251031-0928-B400_B.14-6	10	H1_Day	a15978el	+	+	-	+	+	+	+	Ref EL-04-051.2 f24 Group James_M
5	09:02:48	20251031-0902-B400_B.14-5	10	H1_Day	u50028ip	+	+	-	+	+	+	+	Ref alpha bromo hexanal Group Larrosa_I
4	08:45:54	20251031-0844-B400_B.14-4	10	C13_CPD_Night256	p69506xd	+	+	-	+	+	+	+	Ref STL-XLD-Th(COTii)2-after sublimation-KOtBu Group Liddle_S
29	22:38:57	20251030-2139-B400_B.14-29	11	C13_CPD_Night256	u67812sg	-	+	-	-	-	+	+	Ref sq-01-169-3p Group Procter_D	sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
29	22:34:41	20251030-2139-B400_B.14-29	10	H1_Day	u67812sg	+	+	-	+	+	+	+	Ref sq-01-169-3p Group Procter_D
28	22:20:15	20251030-2139-B400_B.14-28	11	C13_CPD_Night256	u67812sg	-	+	-	-	-	+	+	Ref sq-01-169-2p Group Procter_D	sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
28	22:15:56	20251030-2139-B400_B.14-28	10	H1_Day	u67812sg	+	+	-	+	+	+	+	Ref sq-01-169-2p Group Procter_D
27	22:01:06	20251030-2138-B400_B.14-27	11	C13_CPD_Night256	u67812sg	-	+	-	-	-	+	+	Ref sq-01-169-1p Group Procter_D	sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
27	21:56:36	20251030-2138-B400_B.14-27	10	H1_Day	u67812sg	+	+	-	+	+	+	+	Ref sq-01-169-1p Group Procter_D
26	21:51:38	20251030-1902-B400_B.14-26	10	H1_Night	b26045ab	+	+	-	+	+	+	+	Ref AT-ABO-02-547iso Group Trowbridge_A
25	20:22:51	20251030-1728-B400_B.14-25	10	F19_CPD_Night_1024	mbdxkrn2	+	+	-	+	+	+	+	Ref GDB-RN1578-2 480min sonication MeOH wash phase - C6D6 Group DeBo_G	sref: NUCLEUS '19F' not defined for SOLVENT 'C6D6' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'C6D6' SR is set to 0.0
24	18:53:23	20251030-1727-B400_B.14-24	10	F19_CPD_Night_1024	mbdxkrn2	+	+	-	+	+	+	+	Ref GDB-RN1578-1 480min sonication MeOH wash phase - C6D6 Group DeBo_G	sref: NUCLEUS '19F' not defined for SOLVENT 'C6D6' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'C6D6' SR is set to 0.0
1	18:51:05	20251030-1834-B400_B.14-1	11	F19_CPD_Day	w52164bc	-	+	-	-	-	+	+	Ref BC-11-148 P1 Group James_M	sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0
1	18:46:28	20251030-1834-B400_B.14-1	10	H1_Day	w52164bc	+	+	-	+	+	+	+	Ref BC-11-148 P1 Group James_M
60	18:43:52	20251030-1834-B400_B.14-60	11	F19_CPD_Day	w52164bc	-	+	-	-	-	+	+	Ref BC-11-148 P1 Group James_M	sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0
60	18:39:17	20251030-1834-B400_B.14-60	10	H1_Day	w52164bc	+	+	-	+	+	+	+	Ref BC-11-148 P1 Group James_M
59	18:34:58	20251030-1755-B400_B.14-59	10	H1_Day	a15978el	+	+	-	+	+	+	+	Ref EL-04-064-c Group James_M
58	18:30:22	20251030-1755-B400_B.14-58	10	H1_Day	a15978el	+	+	-	+	+	+	+	Ref EL-04-062 Group James_M
57	18:27:11	20251030-1754-B400_B.14-57	11	F19_NoCPD_Day	mbdxrbj2	-	+	-	-	-	+	+	Ref BJ670_PC Group Procter_D	sref: reference peak outside file limits default calibration done, sref: reference peak outside file limits default calibration done
57	18:22:47	20251030-1754-B400_B.14-57	10	H1_Day	mbdxrbj2	+	+	-	+	+	+	+	Ref BJ670_PC Group Procter_D
56	18:18:15	20251030-1754-B400_B.14-56	10	H1_Day	mbdxrbj2	+	+	-	+	+	+	+	Ref BJ541_2 Group Procter_D
55	18:12:58	20251030-1753-B400_B.14-55	11	F19_Quant_D1_8s_Day	mbdxrbj2	-	+	-	-	-	+	+	Ref BJ653_F_WU Group Procter_D	sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0
55	18:08:32	20251030-1753-B400_B.14-55	10	H1_Quant_NS1_Day	mbdxrbj2	+	+	-	+	+	+	+	Ref BJ653_F_WU Group Procter_D
54	17:52:01	20251030-1330-B400_B.14-54	12	C13_CPD_Night256	z40241jm	+	+	-	+	+	+	+	Ref DJP-JIM-7-130-CAS:91608-15-0 Group Procter_D	sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
53	17:35:09	20251030-1330-B400_B.14-53	12	C13_CPD_Night256	z40241jm	+	+	-	+	+	+	+	Ref DJP-JIM-7-129-CAS:86417-41-0 Group Procter_D	sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
51	17:18:23	20251030-1017-B400_B.14-51	10	C13_CPD_Night256	f92165mh	+	+	-	+	+	+	+	Ref yxc_pvpl Group Hardacre_C	sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
1	17:01:20	20251030-1423-B400_B.14-1	11	C13_CPD_Night256	f09303eg	+	+	-	+	+	+	+	Ref OH Group Webb_S	sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
59	16:56:54	20251030-1647-B400_B.14-59	10	H1_Day	j83970qc	+	+	-	+	+	+	+	Ref qc e675 t0 Group DeBo_G
58	16:51:12	20251030-1409-B400_B.14-58	13	F19_Quant_D1_8s_Day	d93111sd	-	+	-	-	-	+	+	Ref IL-SD-7A Group Larrosa_I	sref: NUCLEUS '19F' not defined for SOLVENT 'DMSO' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'DMSO' SR is set to 0.0
58	16:47:02	20251030-1409-B400_B.14-58	12	H1_Day	d93111sd	+	+	-	+	+	+	+	Ref IL-SD-7A Group Larrosa_I
50	16:30:15	20251030-1016-B400_B.14-50	10	C13_CPD_Night256	f92165mh	+	+	-	+	+	+	+	Ref yxc_pim1 Group Hardacre_C	sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
49	16:12:10	20251030-1016-B400_B.14-49	10	C13_CPD_Night256	f92165mh	+	+	-	+	+	+	+	Ref yxc_pvpm Group Hardacre_C	sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
55	16:07:31	20251030-1559-B400_B.14-55	10	H1_Day	z88883sp	+	+	-	+	+	+	+	Ref SP382d Group Romanov_A Step 2 crude
48	15:50:58	20251030-1015-B400_B.14-48	10	C13_CPD_Night256	f92165mh	+	+	-	+	+	+	+	Ref yxc_0.5 Group Hardacre_C	sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
47	15:34:11	20251030-1015-B400_B.14-47	10	C13_CPD_Night256	f92165mh	+	+	-	+	+	+	+	Ref yxc_0.3 Group Hardacre_C	sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
46	15:24:53	20251030-1418-B400_B.14-46	10	F19_CPD_Night	x73847lm	+	+	-	+	+	+	+	Ref IR-LJM-01-120 Group Riddell_I	sref: reference peak outside file limits default calibration done, sref: reference peak outside file limits default calibration done
45	15:19:57	20251030-1418-B400_B.14-45	10	H1_Day	x73847lm	+	+	-	+	+	+	+	Ref IR-LJM-NaTPB Group Riddell_I
7	15:15:29	20251030-1503-B400_B.14-7	10	H1_Day	u67812sg	+	+	-	+	+	+	+	Ref sq-01-169-3 Group Procter_D
6	15:11:04	20251030-1503-B400_B.14-6	10	H1_Day	u67812sg	+	+	-	+	+	+	+	Ref sq-01-169-2 Group Procter_D
5	15:06:38	20251030-1503-B400_B.14-5	10	H1_Day	u67812sg	+	+	-	+	+	+	+	Ref sq-01-169-1 Group Procter_D
3	15:01:38	20251030-1444-B400_B.14-3	10	H1_Day	b26045ab	+	+	-	+	+	+	+	Ref AT-ABO-02-549-cr Group Trowbridge_A
2	14:57:09	20251030-1444-B400_B.14-2	10	H1_Day	b26045ab	+	+	-	+	+	+	+	Ref AT-ABO-02-548-cr Group Trowbridge_A
1	14:52:09	20251030-1423-B400_B.14-1	10	H1_Day	f09303eg	+	+	-	+	+	+	+	Ref OH Group Webb_S
60	14:47:46	20251030-1415-B400_B.14-60	10	H1_Day	q17816aj	+	+	-	+	+	+	+	Ref IR-AJ-010(13) Group Riddell_I
59	14:42:54	20251030-1415-B400_B.14-59	10	H1_Day	q17816aj	+	+	-	+	+	+	+	Ref IR-AJ-010(11+12) Group Riddell_I
58	14:40:41	20251030-1409-B400_B.14-58	11	F19_CPD_Day	w52164bc	-	+	-	-	-	+	+	Ref BC-11-148 Group James_M	sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0
58	14:36:10	20251030-1409-B400_B.14-58	10	H1_Day	w52164bc	+	+	-	+	+	+	+	Ref BC-11-148 Group James_M
57	14:31:38	20251030-1356-B400_B.14-57	10	H1_Day	j53590ed	+	+	-	+	+	+	+	Ref ED1-007_aC_2-5 Group Greaney_M
56	14:29:21	20251030-1343-B400_B.14-56	12	H1_Day	b72547am	-	+	-	-	-	+	+	Ref 5-21 Group Larrosa_I
56	14:26:54	20251030-1343-B400_B.14-56	11	F19_CPD_Day	b72547am	-	+	-	-	-	+	+	Ref 5-21 Group Larrosa_I	sref: NUCLEUS '19F' not defined for SOLVENT 'C6D6' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'C6D6' SR is set to 0.0
56	14:20:21	20251030-1343-B400_B.14-56	10	F19_Quant_D1_8s_Day	b72547am	+	+	-	+	+	+	+	Ref 5-21 Group Larrosa_I	sref: NUCLEUS '19F' not defined for SOLVENT 'C6D6' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'C6D6' SR is set to 0.0
55	14:16:04	20251030-1401-B400_B.14-55	10	H1_Day	f85241bm	+	+	-	+	+	+	+	Ref bm1002 Group Bures_J mesitylene?
54	14:13:57	20251030-1330-B400_B.14-54	11	P31_CPD_Day	z40241jm	-	+	-	-	-	+	+	Ref DJP-JIM-7-130-CAS:91608-15-0 Group Procter_D	sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0
54	14:09:40	20251030-1330-B400_B.14-54	10	H1_Day	z40241jm	+	+	-	+	+	+	+	Ref DJP-JIM-7-130-CAS:91608-15-0 Group Procter_D
53	14:06:27	20251030-1330-B400_B.14-53	11	P31_CPD_Day	z40241jm	-	+	-	-	-	+	+	Ref DJP-JIM-7-129-CAS:86417-41-0 Group Procter_D	sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0
53	14:01:41	20251030-1330-B400_B.14-53	10	H1_Day	z40241jm	+	+	-	+	+	+	+	Ref DJP-JIM-7-129-CAS:86417-41-0 Group Procter_D
52	13:54:35	20251027-1005-B400_B.14-52	13	F19_Quant_D1_8s_Day	mbdxrbj2	+	+	-	+	+	+	+	Ref BJ653_F Group Procter_D	sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0
46	13:50:12	20251030-1328-B400_B.14-46	10	H1_Day	x73847lm	+	+	-	+	+	+	+	Ref IR-LJM-NaTPB Group Riddell_I
44	13:47:53	20251030-1307-B400_B.14-44	11	F19_CPD_Day	mbdxkrn2	-	+	-	-	-	+	+	Ref GDB-RN1590 Crude hexane wash phase - Acetone-d6 Group DeBo_G	sref: reference peak outside file limits default calibration done, sref: reference peak outside file limits default calibration done
44	13:42:22	20251030-1307-B400_B.14-44	10	H1_Day	mbdxkrn2	+	+	-	+	+	+	+	Ref GDB-RN1590 Crude hexane wash phase - Acetone-d6 Group DeBo_G
43	13:37:49	20251030-1307-B400_B.14-43	11	F19_CPD_Day	mbdxkrn2	-	+	-	-	-	+	+	Ref GDB-RN1590 Crude hexane-washed solid - Acetone-d6 Group DeBo_G	sref: reference peak outside file limits default calibration done, sref: reference peak outside file limits default calibration done
43	13:32:34	20251030-1307-B400_B.14-43	10	H1_Day	mbdxkrn2	+	+	-	+	+	+	+	Ref GDB-RN1590 Crude hexane-washed solid - Acetone-d6 Group DeBo_G
42	13:28:18	20251030-1306-B400_B.14-42	10	H1_Day	a15978el	+	+	-	+	+	+	+	Ref EL-04-061-c Group James_M
41	13:25:24	20251030-1305-B400_B.14-41	11	F19_NoCPD_Day	a15978el	-	+	-	-	-	+	+	Ref EL-04-051.2 f25-30 Group James_M	sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0
41	13:20:54	20251030-1305-B400_B.14-41	10	H1_Day	a15978el	+	+	-	+	+	+	+	Ref EL-04-051.2 f25-30 Group James_M
40	13:04:04	20251030-1118-B400_B.14-40	11	C13_CPD_Night256	f09303eg	+	+	-	+	+	+	+	Ref ref c Group Webb_S	sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
39	12:47:32	20251030-0912-B400_B.14-39	12	C13_CPD_Night256	d93111sd	+	+	-	+	+	+	+	Ref IL-SD-8 Group Larrosa_I	sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
31	12:30:13	20251030-1028-B400_B.14-31	10	C13_CPD_Night256	p69237rb	+	+	-	+	+	+	+	Ref GC RBP08A F2 Group Crisenza_G	sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
39	12:25:32	20251030-0912-B400_B.14-39	11	H1_Day	d93111sd	+	+	-	+	+	+	+	Ref IL-SD-8 Group Larrosa_I
24	12:22:37	20251030-1115-B400_B.14-24	11	P31_Wide_Day	k33462nk	-	+	-	-	-	+	+	Ref nk 1-5 p1 Group Trowbridge_A	sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0
24	12:16:22	20251030-1115-B400_B.14-24	10	H1_Day	k33462nk	+	+	-	+	+	+	+	Ref nk 1-5 p1 Group Trowbridge_A
40	12:11:52	20251030-1118-B400_B.14-40	10	H1_Day	f09303eg	+	+	-	+	+	+	+	Ref ref h Group Webb_S
37	12:09:35	20251030-1150-B400_B.14-37	12	F19_NoCPD_Day	c62220rg	-	+	-	-	-	+	+	Ref phenoxy Group Trowbridge_A	sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0
37	12:06:56	20251030-1150-B400_B.14-37	11	P31_Wide_Day	c62220rg	-	+	-	-	-	+	+	Ref phenoxy Group Trowbridge_A	sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0
37	12:02:10	20251030-1150-B400_B.14-37	10	H1_Day	c62220rg	+	+	-	+	+	+	+	Ref phenoxy Group Trowbridge_A
36	11:57:10	20251030-1141-B400_B.14-36	11	F19_Quant_D1_8s_Day	u50028ip	-	+	-	-	-	+	+	Ref Urea quinoline coupling Group Larrosa_I	sref: NUCLEUS '19F' not defined for SOLVENT 'DMSO' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'DMSO' SR is set to 0.0
36	11:53:02	20251030-1141-B400_B.14-36	10	H1_Day	u50028ip	+	+	-	+	+	+	+	Ref Urea quinoline coupling Group Larrosa_I
35	11:48:32	20251030-1126-B400_B.14-35	10	H1_Day	u50028ip	+	+	-	+	+	+	+	Ref Quinine urea NHBOc Group Larrosa_I
34	11:41:32	20251030-1117-B400_B.14-34	10	F19_Quant_D1_8s_Day	z86427mk	+	+	-	+	+	+	+	Ref MK-256-C Group Procter_D	sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0
33	11:34:30	20251030-1117-B400_B.14-33	10	F19_Quant_D1_8s_Day	z86427mk	+	+	-	+	+	+	+	Ref MK-256-B Group Procter_D	sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0
32	11:26:30	20251030-1116-B400_B.14-32	10	F19_Quant_D1_8s_Day	z86427mk	+	+	-	+	+	+	+	Ref MK-256-A Group Procter_D	sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0
30	11:09:24	20251030-1027-B400_B.14-30	10	C13_CPD_Night256	p69237rb	+	+	-	+	+	+	+	Ref GC RBP08A F1 Group Crisenza_G	sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
59	11:04:09	20251030-1048-B400_B.14-59	10	H1_Day	z40241jm	+	+	-	+	+	+	+	Ref DJP-JIM-7-130-2a-spot1 Group Procter_D
58	10:59:37	20251030-1043-B400_B.14-58	10	H1_Day	b32507dt	+	+	-	+	+	+	+	Ref dt gx 2 4 Group Webb_S
57	10:54:38	20251030-1043-B400_B.14-57	10	H1_Day	b32507dt	+	+	-	+	+	+	+	Ref dt gx 22 Group Webb_S
56	10:49:40	20251030-1043-B400_B.14-56	10	H1_Day	b32507dt	+	+	-	+	+	+	+	Ref dt gx 19 21 Group Webb_S
55	10:45:11	20251030-1042-B400_B.14-55	10	H1_Day	b32507dt	+	+	-	+	+	+	+	Ref dt gx 11 12 Group Webb_S
54	10:40:54	20251030-1021-B400_B.14-54	10	H1_Day	x73847lm	+	+	-	+	+	+	+	Ref IR-LJM-01-124 C2 F48 Group Riddell_I
53	10:36:05	20251030-1020-B400_B.14-53	10	H1_Day	x73847lm	+	+	-	+	+	+	+	Ref IR-LJM-01-124 C2 F40 Group Riddell_I
46	10:19:00	20251030-1014-B400_B.14-46	10	C13_CPD_Night256	f92165mh	+	+	-	+	+	+	+	Ref yxc_0.1 Group Hardacre_C	sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
5	10:05:15	20251030-0959-B400_B.14-5	11	F19_CPD_Day	w52164bc	-	+	-	-	-	+	+	Ref BC-11-145 Group James_M	sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0
5	10:00:34	20251030-0959-B400_B.14-5	10	H1_Day	w52164bc	+	+	-	+	+	+	+	Ref BC-11-145 Group James_M
11	09:46:04	20251030-0945-B400_B.14-11	10	H1_Day	g2777ec	+	+	-	+	+	+	+	Ref RWEC-I-132-1 Group Winpenny_R
39	09:12:36	20251030-0912-B400_B.14-39	10	H1_Day	h91839em	+	+	-	+	+	+	+	Ref rbp 8A 6-10 Group Crisenza_G
38	09:08:44	20251030-0903-B400_B.14-38	11	F19_CPD_Day	mbdxkrn2	-	+	-	-	-	+	+	Ref GDB-RN1589 Column Fractions 45-47 After further PE washing - Acetone-d6 Group DeBo_G	sref: reference peak outside file limits default calibration done, sref: reference peak outside file limits default calibration done
38	09:04:22	20251030-0903-B400_B.14-38	10	H1_Day	mbdxkrn2	+	+	-	+	+	+	+	Ref GDB-RN1589 Column Fractions 45-47 After further PE washing - Acetone-d6 Group DeBo_G
35	08:52:22	20251030-0852-B400_B.14-35	10	H1_Day	u50028ip	+	+	-	+	+	+	+	Ref NP-uerea quinoquilidene BOC Group Larrosa_I
20	08:32:11	20251030-0827-B400_B.14-20	11	F19_CPD_Day	mbdxkrn2	-	+	-	-	-	+	+	Ref GDB-RN1589 Column Fractions 45-47 After PE washing - Acetone-d6 Group DeBo_G	sref: reference peak outside file limits default calibration done, sref: reference peak outside file limits default calibration done
20	08:28:08	20251030-0827-B400_B.14-20	10	H1_Day	mbdxkrn2	+	+	-	+	+	+	+	Ref GDB-RN1589 Column Fractions 45-47 After PE washing - Acetone-d6 Group DeBo_G
16	07:49:33	20251030-0738-B400_B.14-16	11	F19_CPD_Day	mbdxkrn2	-	+	-	-	-	+	+	Ref GDB-RN1589 Column Fractions 48-53 - Acetone-d6 Group DeBo_G	sref: reference peak outside file limits default calibration done, sref: reference peak outside file limits default calibration done
16	07:45:29	20251030-0738-B400_B.14-16	10	H1_Day	mbdxkrn2	+	+	-	+	+	+	+	Ref GDB-RN1589 Column Fractions 48-53 - Acetone-d6 Group DeBo_G
15	07:43:08	20251030-0737-B400_B.14-15	11	F19_CPD_Day	mbdxkrn2	-	+	-	-	-	+	+	Ref GDB-RN1589 Column Fractions 45-47 - Acetone-d6 Group DeBo_G	sref: reference peak outside file limits default calibration done, sref: reference peak outside file limits default calibration done
15	07:38:53	20251030-0737-B400_B.14-15	10	H1_Day	mbdxkrn2	+	+	-	+	+	+	+	Ref GDB-RN1589 Column Fractions 45-47 - Acetone-d6 Group DeBo_G
59	02:48:56	20251029-2012-B400_B.14-59	11	F19_CPD_Night	g23544jd	-	+	-	-	-	+	+	Ref MJJ-JDL-05-070-P2 Group James_M	sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0
59	02:44:40	20251029-2012-B400_B.14-59	10	H1_Night	g23544jd	+	+	-	+	+	+	+	Ref MJJ-JDL-05-070-P2 Group James_M
58	02:37:21	20251029-2012-B400_B.14-58	11	F19_CPD_Night	g23544jd	-	+	-	-	-	+	+	Ref MJJ-JDL-05-070-P1 Group James_M	sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0
58	02:33:05	20251029-2012-B400_B.14-58	10	H1_Night	g23544jd	+	+	-	+	+	+	+	Ref MJJ-JDL-05-070-P1 Group James_M
57	02:28:44	20251029-2012-B400_B.14-57	10	H1_Night	g23544jd	+	+	-	+	+	+	+	Ref MJJ-JDL-05-069-3-P Group James_M
51	02:24:32	20251029-1947-B400_B.14-51	10	H1_Quant_NS1_Day	z40241jm	+	+	-	+	+	+	+	Ref DJP-JIM-7-130-1c Group Procter_D
50	02:20:21	20251029-1947-B400_B.14-50	10	H1_Quant_NS1_Day	z40241jm	+	+	-	+	+	+	+	Ref DJP-JIM-7-130-1b Group Procter_D
49	02:16:24	20251029-1947-B400_B.14-49	10	H1_Quant_NS1_Day	z40241jm	+	+	-	+	+	+	+	Ref DJP-JIM-7-130-1a Group Procter_D
48	02:12:13	20251029-1947-B400_B.14-48	10	H1_Quant_NS1_Day	z40241jm	+	+	-	+	+	+	+	Ref DJP-JIM-7-129-1c Group Procter_D
47	02:08:18	20251029-1947-B400_B.14-47	10	H1_Quant_NS1_Day	z40241jm	+	+	-	+	+	+	+	Ref DJP-JIM-7-129-1b Group Procter_D
46	02:03:47	20251029-1947-B400_B.14-46	10	H1_Quant_NS1_Day	z40241jm	+	+	-	+	+	+	+	Ref DJP-JIM-7-129-1a Group Procter_D
56	01:48:05	20251029-1932-B400_B.14-56	12	C13_CPD_Night256	v73981ac	-	+	-	-	-	+	+	Ref ILAC145 Group Larrosa_I	sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
56	01:42:59	20251029-1932-B400_B.14-56	11	F19_NoCPD_Day	v73981ac	-	+	-	-	-	+	+	Ref ILAC145 Group Larrosa_I	sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0
56	01:38:29	20251029-1932-B400_B.14-56	10	H1_Day	v73981ac	+	+	-	+	+	+	+	Ref ILAC145 Group Larrosa_I
55	01:23:36	20251029-1902-B400_B.14-55	12	C13_CPD_Night256	z65435tw	-	+	-	-	-	+	+	Ref tw-1196-p-nmr-13c-cdcl3 Group Crisenza_G	sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
55	01:21:04	20251029-1902-B400_B.14-55	11	P31_CPD_Day	z65435tw	-	+	-	-	-	+	+	Ref tw-1196-p-nmr-31h-cdcl3 Group Crisenza_G	sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0
55	01:15:19	20251029-1902-B400_B.14-55	10	H1_Day	z65435tw	+	+	-	+	+	+	+	Ref tw-1196-p-nmr-1h-cdcl3 Group Crisenza_G
53	01:00:29	20251029-1850-B400_B.14-53	11	C13_CPD_Night256	g16660ml	-	+	-	-	-	+	+	Ref djp-muze-ring-ester-not-closed Group Procter_D	sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
53	00:45:26	20251029-1850-B400_B.14-53	10	H1_Night128	g16660ml	+	+	-	+	+	+	+	Ref djp-muze-ring-ester-not-closed Group Procter_D
27	00:08:53	20251029-1523-B400_B.14-26	11	H1_WaterSupp_Night	m14269jw	+	+	-	+	+	+	+	Ref IR-JW-BenzoaPyrene Group Riddell_I	sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
26	23:33:09	20251029-1523-B400_B.14-25	11	H1_WaterSupp_Night	m14269jw	+	+	-	+	+	+	+	Ref IR-JW-Pyrazine Group Riddell_I	sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
25	22:57:35	20251029-1523-B400_B.14-24	11	H1_WaterSupp_Night	m14269jw	+	+	-	+	+	+	+	Ref IR-JW-BrAdamantane Group Riddell_I	sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
20	22:21:41	20251029-1523-B400_B.14-19	11	H1_WaterSupp_Night	m14269jw	+	+	-	+	+	+	+	Ref IR-JW-Xanthene Group Riddell_I	sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
19	21:44:52	20251029-1523-B400_B.14-21	11	H1_WaterSupp_Night	m14269jw	+	+	-	+	x	+	+	Ref IR-JW-m-Xylene Group Riddell_I	topshim: TopshimFieldMap - no valid data in sample centre, Shim failed, sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
18	21:08:57	20251029-1523-B400_B.14-18	11	H1_WaterSupp_Night	m14269jw	+	+	-	+	+	+	+	Ref IR-JW-Pyrene Group Riddell_I	sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
45	20:44:55	20251028-1430-B400_B.14-45	13	H1_Quant_d1_56s_Night	p98722sl	+	+	-	+	+	+	+	Ref SL-SC-05 Group Cobb_S
44	20:21:16	20251028-1602-B400_B.14-44	11	H1_Quant_d1_56s_Night	p98722sl	+	+	-	+	+	+	+	Ref SL-SC-04 Group Cobb_S
43	19:57:37	20251028-1602-B400_B.14-43	11	H1_Quant_d1_56s_Night	p98722sl	+	+	-	+	+	+	+	Ref SL-SC-03 Group Cobb_S
42	19:33:43	20251028-1219-B400_B.14-42	13	H1_Quant_d1_56s_Night	p98722sl	+	+	-	+	+	+	+	Ref SL-SC-02 Group Cobb_S
41	19:09:18	20251028-1552-B400_B.14-41	11	H1_Quant_d1_56s_Night	p98722sl	+	+	-	+	+	+	+	Ref SL-SC-01 Group Cobb_S
4	18:36:30	20251029-1741-B400_B.14-4	11	Si29_DEPT90_Day	p69506xd	-	-	-	-	-	-	-	Ref STL-XLD-Th(COTii)2-green-KOtBu Group Liddle_S
4	18:32:04	20251029-1741-B400_B.14-4	10	H1_Day	p69506xd	+	+	-	+	+	+	+	Ref STL-XLD-Th(COTii)2-green-KOtBu Group Liddle_S
1	18:27:33	20251029-1823-B400_B.14-1	10	H1_Day	z16689fe	+	+	-	+	+	+	+	Ref DJP FE 067 (crude) Group Procter_D
60	18:21:52	20251029-1736-B400_B.14-60	11	F19_Quant_D1_8s_Day	d93111sd	-	+	-	-	-	+	+	Ref IL-SD-2B Group Larrosa_I	sref: reference peak outside file limits default calibration done, sref: reference peak outside file limits default calibration done
60	18:17:10	20251029-1736-B400_B.14-60	10	H1_Day	d93111sd	+	+	-	+	+	+	+	Ref IL-SD-2B Group Larrosa_I
54	18:12:44	20251029-1752-B400_B.14-54	11	F19_CPD_Day	w52164bc	-	+	-	-	-	+	+	Ref BC-11-145 Group James_M	sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0
54	18:07:14	20251029-1752-B400_B.14-54	10	H1_Day	w52164bc	+	+	-	+	+	+	+	Ref BC-11-145 Group James_M
53	18:01:40	20251029-1745-B400_B.14-53	10	H1_Day	g16660ml	+	+	-	+	+	+	+	Ref djp-muze Group Procter_D
51	17:57:34	20251029-1739-B400_B.14-51	10	H1_Day	f92165mh	+	+	-	+	+	+	+	Ref yxc_pvpl Group Hardacre_C
50	17:53:03	20251029-1739-B400_B.14-50	10	H1_Day	f92165mh	+	+	-	+	+	+	+	Ref yxc_pim1 Group Hardacre_C
49	17:48:23	20251029-1733-B400_B.14-49	10	H1_Day	f92165mh	+	+	-	+	+	+	+	Ref yxc_pvpm Group Hardacre_C
48	17:44:11	20251029-1732-B400_B.14-48	10	H1_Day	f92165mh	+	+	-	+	+	+	+	Ref yxc_0.5 Group Hardacre_C
47	17:40:06	20251029-1732-B400_B.14-47	10	H1_Day	f92165mh	+	+	-	+	+	+	+	Ref yxc_0.3 Group Hardacre_C
46	17:35:52	20251029-1731-B400_B.14-46	10	H1_Day	f92165mh	+	+	-	+	+	+	+	Ref yxc_0.1 Group Hardacre_C
34	17:11:47	20251029-1711-B400_B.14-34	10	H1_Day	j40457bh	+	+	-	+	+	+	+	Ref bhah140 oh Group Trowbridge_A
33	16:43:46	20251029-1643-B400_B.14-33	10	H1_Day	n06287cb	+	+	-	+	+	+	+	Ref IL-CB-BrCNPhCOOH Group Larrosa_I
32	16:39:01	20251029-1622-B400_B.14-32	11	F19_NoCPD_Day	mbdxrbj2	-	+	-	-	-	+	+	Ref BJ669_PC Group Procter_D	sref: reference peak outside file limits default calibration done, sref: reference peak outside file limits default calibration done
32	16:34:36	20251029-1622-B400_B.14-32	10	H1_Day	mbdxrbj2	+	+	-	+	+	+	+	Ref BJ669_PC Group Procter_D
31	16:30:18	20251029-1621-B400_B.14-31	10	H1_Day	h91839em	+	+	-	+	+	+	+	Ref RBA 8A F2 Group Crisenza_G
30	16:25:44	20251029-1621-B400_B.14-30	10	H1_Day	h91839em	+	+	-	+	+	+	+	Ref RBP 8A F1 Group Crisenza_G
29	16:21:23	20251029-1620-B400_B.14-29	10	H1_Day	h91839em	+	+	-	+	+	+	+	Ref GC EM 152C Group Crisenza_G
28	16:16:07	20251029-1615-B400_B.14-28	10	H1_Day	a15978el	+	+	-	+	+	+	+	Ref EL-04-060-c Group James_M
27	16:09:31	20251029-1523-B400_B.14-26	10	H1_Night	m14269jw	+	+	-	+	+	+	+	Ref IR-JW-BenzoaPyrene Group Riddell_I
26	16:05:11	20251029-1523-B400_B.14-25	10	H1_Night	m14269jw	+	+	-	+	+	+	+	Ref IR-JW-Pyrazine Group Riddell_I
37	16:00:09	20251029-1548-B400_B.14-37	11	F19_Quant_D1_8s_Day	d93111sd	-	+	-	-	-	+	+	Ref IL-SD-7 Group Larrosa_I	sref: NUCLEUS '19F' not defined for SOLVENT 'DMSO' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'DMSO' SR is set to 0.0
37	15:55:55	20251029-1548-B400_B.14-37	10	H1_Day	d93111sd	+	+	-	+	+	+	+	Ref IL-SD-7 Group Larrosa_I
23	15:51:38	20251029-1542-B400_B.14-23	10	H1_Day	mbdxrjr4	+	+	-	+	+	+	+	Ref JR-005-AC2 Group Greaney_M
22	15:46:50	20251029-1542-B400_B.14-22	10	H1_Day	mbdxrjr4	+	+	-	+	+	+	+	Ref JR-CDCl3 Group Greaney_M
25	15:42:30	20251029-1523-B400_B.14-24	10	H1_Night	m14269jw	+	+	-	+	+	+	+	Ref IR-JW-BrAdamantane Group Riddell_I
20	15:37:54	20251029-1523-B400_B.14-19	10	H1_Night	m14269jw	+	+	-	+	+	+	+	Ref IR-JW-Xanthene Group Riddell_I
19	15:32:24	20251029-1523-B400_B.14-21	10	H1_Night	m14269jw	+	+	-	+	x	+	+	Ref IR-JW-m-Xylene Group Riddell_I	topshim: TopshimFieldMap - no valid data in sample centre, Shim failed
18	15:27:28	20251029-1523-B400_B.14-18	10	H1_Night	m14269jw	+	+	-	+	+	+	+	Ref IR-JW-Pyrene Group Riddell_I
17	15:20:55	20251029-1520-B400_B.14-17	10	P31_Wide_Day	q50682hk	+	+	-	+	-	+	+	Ref CJC-04 CRNEAT Group Willcox_D
14	15:09:21	20251029-1440-B400_B.14-14	10	H1_Quant_NS1_Day	z61799af	+	+	-	+	+	+	+	Ref AF-195B Group Larrosa_I
10	15:05:06	20251029-1440-B400_B.14-10	9	H1_Quant_NS1_Day	z61799af	+	+	-	+	+	+	+	Ref AF-195A Group Larrosa_I
8	15:00:55	20251029-1440-B400_B.14-8	10	H1_Quant_NS1_Day	z61799af	+	+	-	+	+	+	+	Ref AF-192B Group Larrosa_I
7	14:56:27	20251029-1440-B400_B.14-7	10	H1_Quant_NS1_Day	z61799af	+	+	-	+	+	+	+	Ref AF-192A Group Larrosa_I
3	14:52:15	20251029-1440-B400_B.14-3	10	H1_Quant_NS1_Day	z61799af	+	+	-	+	+	+	+	Ref AF-186C Group Larrosa_I
2	14:48:03	20251029-1440-B400_B.14-2	10	H1_Quant_NS1_Day	z61799af	+	+	-	+	+	+	+	Ref AF-198B Group Larrosa_I
1	14:43:56	20251029-1440-B400_B.14-1	10	H1_Quant_NS1_Day	z61799af	+	+	-	+	+	+	+	Ref AF-198A Group Larrosa_I
34	13:59:19	20251029-1357-B400_B.14-34	10	H1_Day	mbdxrjr4	+	+	-	+	+	+	+	Ref MFG-JR-005-AC Group Greaney_M
33	13:55:02	20251029-1350-B400_B.14-33	10	H1_Day	y27382tp	+	+	-	+	+	+	+	Ref MIG_TP002_t18 Group Gibson Group t=18hours
32	13:50:18	20251029-1349-B400_B.14-32	10	H1_Day	y27382tp	+	+	-	+	+	+	+	Ref MIG_TP002_t0 Group Gibson Group t=0
18	13:26:40	20251029-1322-B400_B.14-18	10	H1_Day	x73847lm	+	+	-	+	+	+	+	Ref IR-LJM-01-124 C2 F16 Group Riddell_I
17	13:22:14	20251029-1321-B400_B.14-17	10	H1_Day	x73847lm	+	+	-	+	+	+	+	Ref IR-LJM-01-124 C2 F15 Group Riddell_I
13	13:11:47	20251029-1311-B400_B.14-13	10	H1_Day	t13367jb	+	+	-	+	+	+	+	Ref mfg-jb-05-053-c Group Greaney_M mfg-jb-05-053-c
11	12:59:21	20251029-1258-B400_B.14-11	10	H1_Day	g2777ec	+	+	-	+	+	+	+	Ref RWEC-I-132 Group Winpenny_R
10	12:39:36	20251029-1235-B400_B.14-10	10	H1_Day	h91839em	+	+	-	+	+	+	+	Ref gc em 150 rep Group Crisenza_G
8	12:35:22	20251029-1235-B400_B.14-8	10	H1_Day	h91839em	+	+	-	+	+	+	+	Ref gc em 149 rep Group Crisenza_G
1	11:53:34	20251029-1153-B400_B.14-1	10	H1_Day	b72547am	+	+	-	+	+	+	+	Ref 5-27 Group Larrosa_I
14	11:43:24	20251029-1138-B400_B.14-14	10	H1_Day	x73847lm	+	+	-	+	+	+	+	Ref IR_LJM-01-124C2 F14 Group Riddell_I
13	11:38:43	20251029-1138-B400_B.14-13	10	H1_Day	x73847lm	+	+	-	+	+	+	+	Ref IR_LJM-01-124 C2 F17 Group Riddell_I
8	11:30:21	20251029-1130-B400_B.14-8	10	H1_Day	b32507dt	+	+	-	+	+	+	+	Ref dtgb 129 pdt bis Group Webb_S
2	11:12:17	20251029-1109-B400_B.14-2	10	H1_Day	g2777ec	+	+	-	+	+	+	+	Ref RWEC-I-124c Group Winpenny_R
1	11:07:58	20251029-1107-B400_B.14-1	10	H1_Day	e03178pd	+	+	-	+	+	+	+	Ref IL-pdl752.2.cr Group Larrosa_I
1	11:00:34	20251029-1059-B400_B.14-1	10	H1_Day	z16689fe	+	+	-	+	+	+	+	Ref DJP FE 066 (crude) Group Procter_D
31	10:29:42	20251029-1018-B400_B.14-31	10	H1_WaterSupp_Day	a15978el	+	+	-	+	+	+	+	Ref EL-04-063-c Group James_M
30	10:22:53	20251029-1017-B400_B.14-30	10	H1_WaterSupp_Day	a15978el	+	+	-	+	+	+	+	Ref EL-04-062-c Group James_M
29	10:18:46	20251029-0953-B400_B.14-29	10	H1_Day	m14269jw	+	+	-	+	+	+	+	Ref IR-JW-3107-Trit Group Riddell_I
28	10:16:23	20251029-0951-B400_B.14-28	11	F19_CPD_Day	w52164bc	-	+	-	-	-	+	+	Ref BC-11-147 crude Group James_M	sref: NUCLEUS '19F' not defined for SOLVENT 'MeOD' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'MeOD' SR is set to 0.0
28	10:12:31	20251029-0951-B400_B.14-28	10	H1_Day	w52164bc	+	+	-	+	+	+	+	Ref BC-11-147 crude Group James_M
27	10:02:43	20251029-0951-B400_B.14-27	11	F19_CPD_Day	w52164bc	-	+	-	-	-	+	+	Ref BC-11-146 Group James_M	sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0
27	09:58:28	20251029-0951-B400_B.14-27	10	H1_Day	w52164bc	+	+	-	+	+	+	+	Ref BC-11-146 Group James_M
26	09:53:43	20251029-0949-B400_B.14-26	10	H1_Day	u50028ip	+	+	-	+	+	+	+	Ref Quinine-NH2 Group Larrosa_I
25	09:49:29	20251029-0949-B400_B.14-25	10	H1_Day	u50028ip	+	+	-	+	+	+	+	Ref Quinine-OH Group Larrosa_I
24	09:45:22	20251029-0945-B400_B.14-24	10	H1_Day	z40241jm	+	+	-	+	+	+	+	Ref DJP-JIM-7-128-1a Group Procter_D
23	09:29:09	20251029-0920-B400_B.14-23	10	H1_Day	mbdxrjr4	+	+	-	+	+	+	+	Ref MFG-JR-005-O Group Greaney_M
22	09:24:39	20251029-0913-B400_B.14-22	10	H1_Quant_NS1_Day	g23544jd	+	+	-	+	+	+	+	Ref MJJ-JDL-05-072-x Group James_M
20	09:20:12	20251029-0913-B400_B.14-20	10	H1_Quant_NS1_Day	g23544jd	+	+	-	+	+	+	+	Ref MJJ-JDL-05-071-x Group James_M
19	09:15:55	20251029-0903-B400_B.14-19	10	H1_Day	mbdxrjr4	+	+	-	+	+	+	+	Ref MFG-JR-005-Y Group Greaney_M
18	09:11:26	20251029-0903-B400_B.14-18	10	H1_Day	mbdxrjr4	+	+	-	+	+	+	+	Ref MFG-JR-005-B Group Greaney_M
17	09:06:52	20251029-0903-B400_B.14-17	10	H1_Day	mbdxrjr4	+	+	-	+	+	+	+	Ref MFG-JR-005-G Group Greaney_M
16	09:02:10	20251029-0901-B400_B.14-16	10	H1_Day	z40241jm	+	+	-	+	+	+	+	Ref DJP-JIM-7-132-2a Group Procter_D
24	08:29:40	20251029-0811-B400_B.14-24	10	H1_Day	u50028ip	+	+	-	+	+	+	+	Ref Bromo ester ccilico Group Larrosa_I
23	08:24:52	20251029-0811-B400_B.14-23	11	F19_Quant_D1_8s_Day	u50028ip	-	+	-	-	-	+	+	Ref Dppen urea quinoline Group Larrosa_I	sref: NUCLEUS '19F' not defined for SOLVENT 'DMSO' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'DMSO' SR is set to 0.0
23	08:20:45	20251029-0811-B400_B.14-23	10	H1_Day	u50028ip	+	+	-	+	+	+	+	Ref Dppen urea quinoline Group Larrosa_I
22	08:15:29	20251029-0811-B400_B.14-22	11	F19_Quant_D1_8s_Day	u50028ip	-	+	-	-	-	+	+	Ref L tert leucine thiourea Group Larrosa_I	sref: NUCLEUS '19F' not defined for SOLVENT 'DMSO' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'DMSO' SR is set to 0.0
22	08:11:30	20251029-0811-B400_B.14-22	10	H1_Day	u50028ip	+	+	-	+	+	+	+	Ref L tert leucine thiourea Group Larrosa_I
18	07:58:34	20251029-0758-B400_B.14-18	10	H1_Night	z40241jm	x	-	-	-	-	-	-	Ref DJP-JIM-7-132-2a Group Procter_D	WebService Error: 103.310.145:Sample Missing Error:No sample found with Position or Tube ID '1.18'.
14	01:54:29	20251028-1939-B400_B.14-13	10	H1_Night	b26045ab	+	+	-	+	+	+	+	Ref AT-ABO-02-541-F38-42 Group Trowbridge_A
13	01:49:32	20251028-1939-B400_B.14-12	10	H1_Night	b26045ab	+	+	-	+	+	+	+	Ref AT-ABO-02-541-F32-37 Group Trowbridge_A
11	01:45:02	20251028-1939-B400_B.14-11	10	H1_Night	b26045ab	+	+	-	+	+	+	+	Ref AT-ABO-02-541-F26-31 Group Trowbridge_A
10	01:40:33	20251028-1939-B400_B.14-10	10	H1_Night	b26045ab	+	+	-	+	+	+	+	Ref AT-ABO-02-544-cr Group Trowbridge_A
8	01:32:06	20251028-1937-B400_B.14-8	12	C13_DEPT135_Night	b26045ab	-	+	-	-	-	+	+	Ref AT-ABO-02-542-P1 Group Trowbridge_A	sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
8	01:17:39	20251028-1937-B400_B.14-8	11	C13_CPD_Night256	b26045ab	-	+	-	-	-	+	+	Ref AT-ABO-02-542-P1 Group Trowbridge_A	sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
8	01:12:46	20251028-1937-B400_B.14-8	10	H1_Night	b26045ab	+	+	-	+	+	+	+	Ref AT-ABO-02-542-P1 Group Trowbridge_A
48	00:54:50	20251028-1643-B400_B.14-48	11	C13_CPD_Night256	u67812sg	+	+	-	+	+	+	+	Ref sq-01-164-2 Group Procter_D	sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
37	23:25:41	20251028-1525-B400_B.14-37	10	F19_CPD_Night_1024	mbdxkrn2	+	+	-	+	+	+	+	Ref GDB-RN1578-2 480min sonication crude polymer - C6D6 Group DeBo_G	sref: NUCLEUS '19F' not defined for SOLVENT 'C6D6' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'C6D6' SR is set to 0.0
36	21:55:24	20251028-1525-B400_B.14-36	10	F19_CPD_Night_1024	mbdxkrn2	+	+	-	+	+	+	+	Ref GDB-RN1578-1 480min sonication crude polymer - C6D6 Group DeBo_G	sref: NUCLEUS '19F' not defined for SOLVENT 'C6D6' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'C6D6' SR is set to 0.0
45	21:40:31	20251028-1430-B400_B.14-45	12	C13_CPD_Night256	s77396es	-	+	-	-	-	+	+	Ref ETS47 Group Goodwin_C ETS47_La(II)+S8_THF(pure)_13C	sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
45	21:26:30	20251028-1430-B400_B.14-45	11	H1_COSY_HiRes_Night	s77396es	+	+	-	+	+	+	+	Ref ETS47 Group Goodwin_C ETS47_La(II)+S8_THF(pure)_1HCOSY
7	21:00:45	20251028-1315-B400_B.14-7	21	P31_NoCPD_Night	a76294rm	-	+	-	-	-	+	+	Ref REM-319-LuP4-Et2O-better Group Goodwin_C
7	20:34:47	20251028-1315-B400_B.14-7	20	P31_CPD_Night	a76294rm	-	+	-	-	-	+	+	Ref REM-319-LuP4-Et2O-better Group Goodwin_C
7	20:09:03	20251028-1315-B400_B.14-7	19	P31_NoCPD_Night	a76294rm	-	+	-	-	-	+	+	Ref REM-319-LuP4-Et2O-better Group Goodwin_C	pp: Cannot find any peak for scaling in /mnt/nmrdata/Goodwin_C/data/a76294rm/nmr/20251028-1315-B400_B.14-7/19/pdata/1/peaks!, pp: Cannot find any peak for scaling in /mnt/nmrdata/Goodwin_C/data/a76294rm/nmr/20251028-1315-B400_B.14-7/19/pdata/1/peaks!
7	19:43:02	20251028-1315-B400_B.14-7	18	P31_CPD_Night	a76294rm	-	+	-	-	-	+	+	Ref REM-319-LuP4-Et2O-better Group Goodwin_C	pp: Cannot find any peak for scaling in /mnt/nmrdata/Goodwin_C/data/a76294rm/nmr/20251028-1315-B400_B.14-7/18/pdata/1/peaks!, pp: Cannot find any peak for scaling in /mnt/nmrdata/Goodwin_C/data/a76294rm/nmr/20251028-1315-B400_B.14-7/18/pdata/1/peaks!
7	19:17:16	20251028-1315-B400_B.14-7	17	P31_NoCPD_Night	a76294rm	-	+	-	-	-	+	+	Ref REM-319-LuP4-Et2O-better Group Goodwin_C
7	18:50:06	20251028-1315-B400_B.14-7	16	P31_CPD_Night	a76294rm	+	+	-	+	-	+	+	Ref REM-319-LuP4-Et2O-better Group Goodwin_C
45	18:35:31	20251028-1430-B400_B.14-45	10	H1_Night128	s77396es	+	+	-	+	+	+	+	Ref ETS47 Group Goodwin_C ETS47_La(II)+S8_THF(pure)_1H
1	18:30:42	20251028-1815-B400_B.14-1	10	H1_Day	z16689fe	+	+	-	+	+	+	+	Ref DJP FE 063 (crude) Group Procter_D
42	18:13:57	20251028-1219-B400_B.14-42	12	C13_CPD_Night256	d93111sd	+	+	-	+	+	+	+	Ref IL-SD-6 Group Larrosa_I	sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
48	18:09:15	20251028-1643-B400_B.14-48	10	H1_Day	u67812sg	+	+	-	+	+	+	+	Ref sq-01-164-2 Group Procter_D
47	18:04:42	20251028-1631-B400_B.14-47	10	H1_Day	u67812sg	+	+	-	+	+	+	+	Ref sq-01-169-1-3 Group Procter_D
46	17:59:52	20251028-1536-B400_B.14-46	10	H1_Day	g16660ml	+	+	-	+	+	+	+	Ref djp-muze Group Procter_D
44	17:55:38	20251028-1602-B400_B.14-44	10	H1_Day	n29715ss	+	+	-	+	+	+	+	Ref DJP-SS-22 Group Procter_D
43	17:50:55	20251028-1602-B400_B.14-43	10	H1_Day	n29715ss	+	+	-	+	+	+	+	Ref DJP-SS-2repeat Group Procter_D
7	17:48:49	20251028-1315-B400_B.14-7	15	P31_NoCPD_Day	a76294rm	-	+	-	-	-	+	+	Ref REM-319-LuP4-Et2O-better Group Goodwin_C	pp: Cannot find any peak for scaling in /mnt/nmrdata/Goodwin_C/data/a76294rm/nmr/20251028-1315-B400_B.14-7/15/pdata/1/peaks!, pp: Cannot find any peak for scaling in /mnt/nmrdata/Goodwin_C/data/a76294rm/nmr/20251028-1315-B400_B.14-7/15/pdata/1/peaks!
7	17:45:35	20251028-1315-B400_B.14-7	14	P31_CPD_Day	a76294rm	+	+	-	+	-	+	+	Ref REM-319-LuP4-Et2O-better Group Goodwin_C
59	17:40:08	20251028-1728-B400_B.14-59	10	H1_Day	z88883sp	+	+	-	+	+	+	+	Ref SP382b Group Romanov_A Column band 1
58	17:35:03	20251028-1722-B400_B.14-58	10	H1_Day	j40457bh	+	+	-	+	+	+	+	Ref bhah132 c1s2 Group Trowbridge_A
57	17:30:41	20251028-1720-B400_B.14-57	10	H1_Day	y52364mw	+	+	-	+	+	+	+	Ref GDB-MJ-318 Group DeBo_G
56	17:26:26	20251028-1716-B400_B.14-56	10	H1_Day	m52750pm	+	+	-	+	+	+	+	Ref GCPM164cr Group Crisenza_G
55	17:21:27	20251028-1704-B400_B.14-55	10	H1_Day	c37930an	+	+	-	+	+	+	+	Ref AN-Hex_cdcl3 Group Liddle_S
54	17:16:54	20251028-1701-B400_B.14-54	10	H1_Day	z88883sp	+	+	-	+	+	+	+	Ref SP382c Group Romanov_A Column band 2
53	17:12:24	20251028-1658-B400_B.14-53	10	H1_Day	a15978el	+	+	-	+	+	+	+	Ref EL-04-052.2 f16-35 Group James_M
52	17:08:08	20251027-1005-B400_B.14-52	13	H1_Day	z40241jm	+	+	-	+	+	+	+	Ref DJP-JIM-7-132-1a-crude Group Procter_D
51	17:03:54	20251028-1656-B400_B.14-51	10	H1_Day	h91839em	+	+	-	+	+	+	+	Ref GC EM 151 C Group Crisenza_G
50	16:59:24	20251028-1656-B400_B.14-50	10	H1_Day	h91839em	+	+	-	+	+	+	+	Ref GC EM 150 C Group Crisenza_G
49	16:55:05	20251028-1650-B400_B.14-49	10	H1_Day	r25963ar	+	+	-	+	+	+	+	Ref EtCAACAuCl Group Romanov_A EtCAACAuCl
42	16:50:20	20251028-1219-B400_B.14-42	11	H1_Day	d93111sd	+	+	-	+	+	+	+	Ref IL-SD-6 Group Larrosa_I
41	16:45:50	20251028-1552-B400_B.14-41	10	H1_Day	a15978el	+	+	-	+	+	+	+	Ref EL-trimet 251027 Group James_M
40	16:41:06	20251028-1529-B400_B.14-40	10	H1_Day	h91839em	+	+	-	+	+	+	+	Ref RBP 8 C Group Crisenza_G
39	16:36:48	20251028-1529-B400_B.14-39	10	H1_Day	h91839em	+	+	-	+	+	+	+	Ref GC EM 151 C Group Crisenza_G
38	16:31:21	20251028-1528-B400_B.14-38	10	H1_Day	h91839em	+	+	-	+	+	+	+	Ref GC EM 150 C Group Crisenza_G
35	16:28:57	20251028-1524-B400_B.14-35	11	F19_CPD_Day	mbdxkrn2	-	+	-	-	-	+	+	Ref GDB-RN1584 Column'd Product after PE wash - Acetone-d6 Group DeBo_G	sref: reference peak outside file limits default calibration done, sref: reference peak outside file limits default calibration done
35	16:24:28	20251028-1524-B400_B.14-35	10	H1_Day	mbdxkrn2	+	+	-	+	+	+	+	Ref GDB-RN1584 Column'd Product after PE wash - Acetone-d6 Group DeBo_G
34	16:22:13	20251028-1522-B400_B.14-34	12	P31_CPD_Day	g23544jd	-	+	-	-	-	+	+	Ref MJJ-JDL-06-002-3-24h Group James_M	sref: NUCLEUS '31P' not defined for SOLVENT 'DMSO' SR is set to 0.0, sref: NUCLEUS '31P' not defined for SOLVENT 'DMSO' SR is set to 0.0
34	16:17:25	20251028-1522-B400_B.14-34	11	F19_Quant_D1_8s_Day	g23544jd	-	+	-	-	-	+	+	Ref MJJ-JDL-06-002-3-24h Group James_M	sref: NUCLEUS '19F' not defined for SOLVENT 'DMSO' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'DMSO' SR is set to 0.0
34	16:13:18	20251028-1522-B400_B.14-34	10	H1_Quant_NS1_Day	g23544jd	+	+	-	+	+	+	+	Ref MJJ-JDL-06-002-3-24h Group James_M
33	16:11:00	20251028-1522-B400_B.14-33	12	P31_CPD_Day	g23544jd	-	+	-	-	-	+	+	Ref MJJ-JDL-06-002-2-24h Group James_M	sref: NUCLEUS '31P' not defined for SOLVENT 'DMSO' SR is set to 0.0, sref: NUCLEUS '31P' not defined for SOLVENT 'DMSO' SR is set to 0.0
33	16:06:10	20251028-1522-B400_B.14-33	11	F19_Quant_D1_8s_Day	g23544jd	-	+	-	-	-	+	+	Ref MJJ-JDL-06-002-2-24h Group James_M	sref: NUCLEUS '19F' not defined for SOLVENT 'DMSO' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'DMSO' SR is set to 0.0
33	16:02:47	20251028-1522-B400_B.14-33	10	H1_Quant_NS1_Day	g23544jd	+	+	-	+	+	+	+	Ref MJJ-JDL-06-002-2-24h Group James_M
32	16:00:21	20251028-1522-B400_B.14-32	12	P31_CPD_Day	g23544jd	-	+	-	-	-	+	+	Ref MJJ-JDL-06-002-1-24h Group James_M	sref: NUCLEUS '31P' not defined for SOLVENT 'DMSO' SR is set to 0.0, sref: NUCLEUS '31P' not defined for SOLVENT 'DMSO' SR is set to 0.0
32	15:55:20	20251028-1522-B400_B.14-32	11	F19_Quant_D1_8s_Day	g23544jd	-	+	-	-	-	+	+	Ref MJJ-JDL-06-002-1-24h Group James_M	sref: NUCLEUS '19F' not defined for SOLVENT 'DMSO' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'DMSO' SR is set to 0.0
32	15:51:20	20251028-1522-B400_B.14-32	10	H1_Quant_NS1_Day	g23544jd	+	+	-	+	+	+	+	Ref MJJ-JDL-06-002-1-24h Group James_M
31	15:46:35	20251028-1508-B400_B.14-31	10	H1_Day	m52750pm	+	+	-	+	+	+	+	Ref GCPM161-crop1 Group Crisenza_G
30	15:41:58	20251028-1503-B400_B.14-30	10	H1_Day	g2777ec	+	+	-	+	+	+	+	Ref RWEC-I-124b Group Winpenny_R
29	15:37:27	20251028-1502-B400_B.14-29	10	H1_Day	g2777ec	+	+	-	+	+	+	+	Ref RWEC-I-124a Group Winpenny_R
28	15:33:12	20251028-1456-B400_B.14-28	10	H1_Day	j53590ed	+	+	-	+	+	+	+	Ref ED1-007_crude Group Greaney_M
27	15:31:20	20251028-1402-B400_B.14-27	11	F19_NoCPD_Day	a15978el	-	+	-	-	-	+	+	Ref EL-04-051-f18-22 Group James_M	sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0
27	15:26:23	20251028-1402-B400_B.14-27	10	H1_Day	a15978el	+	+	-	+	+	+	+	Ref EL-04-051-f18-22 Group James_M
26	15:24:30	20251028-1402-B400_B.14-26	11	F19_NoCPD_Day	a15978el	-	+	-	-	-	+	+	Ref EL-04-051-f16-17 Group James_M	sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0
26	15:19:59	20251028-1402-B400_B.14-26	10	H1_Day	a15978el	+	+	-	+	+	+	+	Ref EL-04-051-f16-17 Group James_M
25	15:17:58	20251028-1401-B400_B.14-25	11	F19_NoCPD_Day	a15978el	-	+	-	-	-	+	+	Ref EL-04-051-f12-15 Group James_M	sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0
25	15:13:05	20251028-1401-B400_B.14-25	10	H1_Day	a15978el	+	+	-	+	+	+	+	Ref EL-04-051-f12-15 Group James_M
24	15:08:17	20251028-1353-B400_B.14-24	10	H1_Day	p10102hz	+	+	-	+	+	+	+	Ref zhb-a-127f Group Procter_D
23	15:03:19	20251028-1353-B400_B.14-23	10	H1_Day	p10102hz	+	+	-	+	+	+	+	Ref zhb-a-127e Group Procter_D
22	15:01:12	20251028-1436-B400_B.14-22	16	P31_NoCPD_Day	a76294rm	-	+	-	-	-	+	+	Ref REM-321-LuP4insitu Group Goodwin_C	sref: reference peak outside file limits default calibration done, sref: reference peak outside file limits default calibration done
22	14:59:02	20251028-1436-B400_B.14-22	15	P31_CPD_Day	a76294rm	-	+	-	-	-	+	+	Ref REM-321-LuP4insitu Group Goodwin_C	sref: reference peak outside file limits default calibration done, sref: reference peak outside file limits default calibration done
22	14:56:49	20251028-1436-B400_B.14-22	14	P31_NoCPD_Day	a76294rm	-	+	-	-	-	+	+	Ref REM-321-LuP4insitu Group Goodwin_C	sref: reference peak outside file limits default calibration done, sref: reference peak outside file limits default calibration done
22	14:54:26	20251028-1436-B400_B.14-22	13	P31_NoCPD_Day	a76294rm	-	+	-	-	-	+	+	Ref REM-321-LuP4insitu Group Goodwin_C	sref: reference peak outside file limits default calibration done, sref: reference peak outside file limits default calibration done
22	14:52:18	20251028-1436-B400_B.14-22	12	P31_CPD_Day	a76294rm	-	+	-	-	-	+	+	Ref REM-321-LuP4insitu Group Goodwin_C	sref: reference peak outside file limits default calibration done, sref: reference peak outside file limits default calibration done
22	14:49:50	20251028-1436-B400_B.14-22	11	P31_CPD_Day	a76294rm	-	+	-	-	-	+	+	Ref REM-321-LuP4insitu Group Goodwin_C	sref: reference peak outside file limits default calibration done, sref: reference peak outside file limits default calibration done
22	14:45:42	20251028-1436-B400_B.14-22	10	H1_Day	a76294rm	+	+	-	+	+	+	+	Ref REM-321-LuP4insitu Group Goodwin_C
20	14:40:46	20251028-1434-B400_B.14-20	10	H1_Day	j40457bh	+	+	-	+	+	+	+	Ref bhah139 Group Trowbridge_A
19	14:35:38	20251028-1434-B400_B.14-19	10	H1_Day	j40457bh	+	+	-	+	+	+	+	Ref bhah132 c1 Group Trowbridge_A
18	14:30:51	20251028-1352-B400_B.14-18	10	H1_Day	p10102hz	+	+	-	+	+	+	+	Ref zhb-a-127d Group Procter_D
17	14:26:03	20251028-1352-B400_B.14-17	10	H1_Day	p10102hz	+	+	-	+	+	+	+	Ref zhb-a-127c Group Procter_D
16	14:21:23	20251028-1352-B400_B.14-16	10	H1_Day	p10102hz	+	+	-	+	+	+	+	Ref zhb-a-127b Group Procter_D
15	14:17:11	20251028-1346-B400_B.14-15	11	F19_CPD_Day	mbdxkrn2	-	+	-	-	-	+	+	Ref GDB-RN1584 Column Main Band - Acetone-d6 Group DeBo_G	sref: reference peak outside file limits default calibration done, sref: reference peak outside file limits default calibration done
15	14:12:37	20251028-1346-B400_B.14-15	10	H1_Day	mbdxkrn2	+	+	-	+	+	+	+	Ref GDB-RN1584 Column Main Band - Acetone-d6 Group DeBo_G
14	14:08:44	20251028-1341-B400_B.14-14	10	H1_Day	j31752jy	+	+	-	+	+	+	+	Ref HEA200-t1 Group Gibson_M
13	14:04:50	20251028-1341-B400_B.14-13	10	H1_Day	j31752jy	+	+	-	+	+	+	+	Ref HEA200-t0 Group Gibson_M
12	13:59:50	20251027-1420-B400_B.14-12	11	H1_Day	p10102hz	+	+	-	+	+	+	+	Ref zhb-a-127a Group Procter_D
11	13:55:51	20251028-1340-B400_B.14-11	10	H1_Day	j31752jy	+	+	-	+	+	+	+	Ref HEA150-t1 Group Gibson_M
10	13:51:49	20251028-1340-B400_B.14-10	10	H1_Day	j31752jy	+	+	-	+	+	+	+	Ref HEA150-t0 Group Gibson_M
8	13:47:07	20251028-1330-B400_B.14-8	10	H1_Day	z88883sp	+	+	-	+	+	+	+	Ref SP382a Group Romanov_A MeOH washings
7	13:45:01	20251028-1315-B400_B.14-7	13	P31_NoCPD_Day	a76294rm	-	+	-	-	-	+	+	Ref REM-319-LuP4-Et2O-better Group Goodwin_C	pp: Cannot find any peak for scaling in /mnt/nmrdata/Goodwin_C/data/a76294rm/nmr/20251028-1315-B400_B.14-7/13/pdata/1/peaks!, pp: Cannot find any peak for scaling in /mnt/nmrdata/Goodwin_C/data/a76294rm/nmr/20251028-1315-B400_B.14-7/13/pdata/1/peaks!
7	13:42:50	20251028-1315-B400_B.14-7	12	P31_CPD_Day	a76294rm	-	+	-	-	-	+	+	Ref REM-319-LuP4-Et2O-better Group Goodwin_C	pp: Cannot find any peak for scaling in /mnt/nmrdata/Goodwin_C/data/a76294rm/nmr/20251028-1315-B400_B.14-7/12/pdata/1/peaks!, pp: Cannot find any peak for scaling in /mnt/nmrdata/Goodwin_C/data/a76294rm/nmr/20251028-1315-B400_B.14-7/12/pdata/1/peaks!
7	13:40:43	20251028-1315-B400_B.14-7	11	P31_NoCPD_Day	a76294rm	-	+	-	-	-	+	+	Ref REM-319-LuP4-Et2O-better Group Goodwin_C
7	13:37:39	20251028-1315-B400_B.14-7	10	P31_CPD_Day	a76294rm	+	+	-	+	-	+	+	Ref REM-319-LuP4-Et2O-better Group Goodwin_C
6	13:33:23	20251028-1147-B400_B.14-6	11	H1_Day	y03998so	+	+	-	+	+	+	+	Ref DJP SO18 Group Procter_D
5	13:29:06	20251028-1146-B400_B.14-5	10	H1_Day	y03998so	+	+	-	+	+	+	+	Ref DJP SO17 Group Procter_D
4	13:24:19	20251028-1137-B400_B.14-4	10	H1_Day	b59259yj	+	+	-	+	+	+	+	Ref MTYJrecheckcapa Group Turner_M
3	13:20:02	20251028-1137-B400_B.14-3	10	H1_Day	b59259yj	+	+	-	+	+	+	+	Ref MTYJrecheck6HCA Group Turner_M
2	13:14:52	20251028-1136-B400_B.14-2	10	H1_Day	b59259yj	+	+	-	+	+	+	+	Ref MTYJB58days Group Turner_M
1	13:09:55	20251028-1135-B400_B.14-1	10	H1_Day	z16689fe	+	+	-	+	+	+	+	Ref DJP FE 062 Group Procter_D
48	13:05:26	20251028-1242-B400_B.14-48	10	H1_Day	h68355ac	+	+	-	+	+	+	+	Ref MFG-AC-660-(b) Group Greaney_M
47	13:00:39	20251028-1242-B400_B.14-47	10	H1_Day	h68355ac	+	+	-	+	+	+	+	Ref MFG-AC-660-(a) Group Greaney_M
46	12:55:49	20251028-1241-B400_B.14-46	10	H1_Day	h68355ac	+	+	-	+	+	+	+	Ref MFG-AC-658-S2-w.u. Group Greaney_M
44	12:51:06	20251028-1222-B400_B.14-44	10	H1_Day	z69889rb	+	+	-	+	+	+	+	Ref SE142R Group Crisenza_G
43	12:46:37	20251028-1221-B400_B.14-43	10	H1_Day	z88883sp	+	+	-	+	+	+	+	Ref SP382 Group Romanov_A MeOH washed
42	12:42:09	20251028-1219-B400_B.14-42	10	H1_Day	j40457bh	+	+	-	+	+	+	+	Ref bhah138 Group Trowbridge_A
41	12:37:54	20251028-1219-B400_B.14-41	10	H1_Day	j40457bh	+	+	-	+	+	+	+	Ref bhah137 Group Trowbridge_A
40	12:33:23	20251028-1215-B400_B.14-40	10	H1_Day	b26045ab	+	+	-	+	+	+	+	Ref AT-ABO-02-542-iso-2 Group Trowbridge_A
39	12:28:35	20251028-1202-B400_B.14-39	10	H1_Day	x73847lm	+	+	-	+	+	+	+	Ref IR-LJM-01-120B with TMS Group Riddell_I
38	12:26:10	20251028-1159-B400_B.14-38	11	F19_CPD_Day	w52164bc	-	+	-	-	-	+	+	Ref BC-11-145 Group James_M	sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0
38	12:21:54	20251028-1159-B400_B.14-38	10	H1_Day	w52164bc	+	+	-	+	+	+	+	Ref BC-11-145 Group James_M
37	12:17:38	20251028-1157-B400_B.14-37	10	H1_Day	mbdxrbj2	+	+	-	+	+	+	+	Ref BJ668_REC Group Procter_D
36	12:12:53	20251028-1156-B400_B.14-36	10	H1_Day	mbdxrbj2	+	+	-	+	+	+	+	Ref BJ634_PC Group Procter_D
35	12:08:36	20251028-1152-B400_B.14-35	10	H1_Day	g2777ec	+	+	-	+	+	+	+	Ref RWEC-I-124 Group Winpenny_R
34	12:05:58	20251028-1133-B400_B.14-34	15	P31_Extrawide_Day	a76294rm	-	+	-	-	-	+	+	Ref REM-319 Group Goodwin_C REM-319-LuP4-Et2O	pp: Cannot find any peak for scaling in /mnt/nmrdata/Goodwin_C/data/a76294rm/nmr/20251028-1133-B400_B.14-34/15/pdata/1/peaks!, pp: Cannot find any peak for scaling in /mnt/nmrdata/Goodwin_C/data/a76294rm/nmr/20251028-1133-B400_B.14-34/15/pdata/1/peaks!
34	12:03:20	20251028-1133-B400_B.14-34	14	P31_Extrawide_Day	a76294rm	-	+	-	-	-	+	+	Ref REM-319 Group Goodwin_C REM-319-LuP4-Et2O	pp: Cannot find any peak for scaling in /mnt/nmrdata/Goodwin_C/data/a76294rm/nmr/20251028-1133-B400_B.14-34/14/pdata/1/peaks!, pp: Cannot find any peak for scaling in /mnt/nmrdata/Goodwin_C/data/a76294rm/nmr/20251028-1133-B400_B.14-34/14/pdata/1/peaks!
34	12:01:14	20251028-1133-B400_B.14-34	13	P31_NoCPD_Day	a76294rm	-	+	-	-	-	+	+	Ref REM-319 Group Goodwin_C REM-319-LuP4-Et2O	pp: Cannot find any peak for scaling in /mnt/nmrdata/Goodwin_C/data/a76294rm/nmr/20251028-1133-B400_B.14-34/13/pdata/1/peaks!, pp: Cannot find any peak for scaling in /mnt/nmrdata/Goodwin_C/data/a76294rm/nmr/20251028-1133-B400_B.14-34/13/pdata/1/peaks!
34	11:59:07	20251028-1133-B400_B.14-34	12	P31_NoCPD_Day	a76294rm	-	+	-	-	-	+	+	Ref REM-319 Group Goodwin_C REM-319-LuP4-Et2O
34	11:56:58	20251028-1133-B400_B.14-34	11	P31_CPD_Day	a76294rm	-	+	-	-	-	+	+	Ref REM-319 Group Goodwin_C REM-319-LuP4-Et2O	pp: Cannot find any peak for scaling in /mnt/nmrdata/Goodwin_C/data/a76294rm/nmr/20251028-1133-B400_B.14-34/11/pdata/1/peaks!, pp: Cannot find any peak for scaling in /mnt/nmrdata/Goodwin_C/data/a76294rm/nmr/20251028-1133-B400_B.14-34/11/pdata/1/peaks!
34	11:53:53	20251028-1133-B400_B.14-34	10	P31_CPD_Day	a76294rm	+	+	-	+	-	+	+	Ref REM-319 Group Goodwin_C REM-319-LuP4-Et2O
33	11:48:08	20251028-1127-B400_B.14-33	10	H1_Quant_NS1_Day	z86427mk	+	+	-	+	+	+	+	Ref MK-254-C Group Procter_D
32	11:42:46	20251028-1127-B400_B.14-32	10	H1_Quant_NS1_Day	z86427mk	+	+	-	+	+	+	+	Ref MK-254-B Group Procter_D
31	11:36:43	20251028-1127-B400_B.14-31	11	F19_Quant_D1_8s_Day	z86427mk	-	+	-	-	-	+	+	Ref MK-254-A Group Procter_D	sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0
31	11:31:34	20251028-1127-B400_B.14-31	10	H1_Quant_NS1_Day	z86427mk	+	+	-	+	+	+	+	Ref MK-254-A Group Procter_D
30	11:27:09	20251028-1009-B400_B.14-30	10	H1_Quant_NS1_Day	g23544jd	+	+	-	+	+	+	+	Ref MJJ-JDL-05-070-3-x Group James_M
29	11:23:12	20251028-1009-B400_B.14-29	10	H1_Quant_NS1_Day	g23544jd	+	+	-	+	+	+	+	Ref MJJ-JDL-05-070-2-x Group James_M
28	11:18:31	20251028-1009-B400_B.14-28	10	H1_Quant_NS1_Day	g23544jd	+	+	-	+	+	+	+	Ref MJJ-JDL-05-069-3-x Group James_M
24	11:14:04	20251028-1008-B400_B.14-24	10	H1_Quant_NS1_Day	g23544jd	+	+	-	+	+	+	+	Ref MJJ-JDL-05-069-2-x Group James_M
23	10:14:29	20251028-1008-B400_B.14-23	10	H1_Quant_NS1_Day	g23544jd	+	+	-	+	+	+	+	Ref MJJ-JDL-05-068-3-x Group James_M	Automation was stopped by user
22	10:09:34	20251028-1008-B400_B.14-22	10	H1_Quant_NS1_Day	g23544jd	+	+	-	+	+	+	+	Ref MJJ-JDL-05-068-2-x Group James_M
14	08:17:16	20251028-0815-B400_B.14-14	10	H1_Day	b26045ab	+	+	-	+	+	+	+	Ref AT-ABO-02-540-cr Group Trowbridge_A
13	08:12:45	20251028-0811-B400_B.14-13	10	H1_Day	mbdxkrn2	+	+	-	+	+	+	+	Ref GDB-RN Triphenylchlorosilane crude - Basic CDCl3 Group DeBo_G
58	03:46:31	20251027-2107-B400_B.14-58	10	H1_Night	y52364mw	+	+	-	+	+	+	+	Ref GDB-MJ-157-P2 Group DeBo_G
57	03:42:02	20251027-2107-B400_B.14-57	10	H1_Night	y52364mw	+	+	-	+	+	+	+	Ref GDB-MJ-157-P1 Group DeBo_G
56	03:27:37	20251027-1928-B400_B.14-56	11	C13_CPD_Night256	u67812sg	-	+	-	-	-	+	+	Ref sq-01-168-4p Group Procter_D	sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
56	03:23:08	20251027-1928-B400_B.14-56	10	H1_Day	u67812sg	+	+	-	+	+	+	+	Ref sq-01-168-4p Group Procter_D
55	03:08:43	20251027-1927-B400_B.14-55	11	C13_CPD_Night256	u67812sg	-	+	-	-	-	+	+	Ref sq-01-168-3p Group Procter_D	sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
55	03:04:12	20251027-1927-B400_B.14-55	10	H1_Day	u67812sg	+	+	-	+	+	+	+	Ref sq-01-168-3p Group Procter_D
54	02:59:54	20251027-1920-B400_B.14-54	10	H1_Day	f85241bm	+	+	-	+	+	+	+	Ref BM999-2 Group Bures_J
53	02:55:23	20251027-1920-B400_B.14-53	10	H1_Day	f85241bm	+	+	-	+	+	+	+	Ref BM999-1 Group Bures_J
16	02:40:55	20251027-1753-B400_B.14-16	11	C13_CPD_Night256	b59259yj	-	+	-	-	-	+	+	Ref MTYJ6HCAtestcheck Group Turner_M	sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
16	02:36:40	20251027-1753-B400_B.14-16	10	H1_Day	b59259yj	+	+	-	+	+	+	+	Ref MTYJ6HCAtestcheck Group Turner_M
15	02:22:08	20251027-1751-B400_B.14-15	11	C13_CPD_Night256	b59259yj	-	+	-	-	-	+	+	Ref MTYJCapacheck27102025 Group Turner_M	sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
15	02:17:25	20251027-1751-B400_B.14-15	10	H1_Day	b59259yj	+	+	-	+	+	+	+	Ref MTYJCapacheck27102025 Group Turner_M
11	01:53:05	20251027-1750-B400_B.14-11	10	H1_Quant_d1_56s_Night	m56482jm	+	+	-	+	+	+	+	Ref JAM008 Group Cobb_S
10	01:28:41	20251027-1749-B400_B.14-10	10	H1_Quant_d1_56s_Night	m56482jm	+	+	-	+	+	+	+	Ref JAM007 Group Cobb_S
8	01:04:27	20251027-1747-B400_B.14-8	10	H1_Quant_d1_56s_Night	m56482jm	+	+	-	+	+	+	+	Ref JAM006 Group Cobb_S
7	00:40:13	20251027-1746-B400_B.14-7	10	H1_Quant_d1_56s_Night	m56482jm	+	+	-	+	+	+	+	Ref JAM005 Group Cobb_S
6	00:15:54	20251027-1745-B400_B.14-6	10	H1_Quant_d1_56s_Night	m56482jm	+	+	-	+	+	+	+	Ref JAM004 Group Cobb_S
5	23:51:26	20251027-1744-B400_B.14-5	10	H1_Quant_d1_56s_Night	m56482jm	+	+	-	+	+	+	+	Ref JAM003 Group Cobb_S
4	23:26:54	20251027-1743-B400_B.14-4	10	H1_Quant_d1_56s_Night	m56482jm	+	+	-	+	+	+	+	Ref JAM002 Group Cobb_S
3	23:02:36	20251027-1742-B400_B.14-3	10	H1_Quant_d1_56s_Night	m56482jm	+	+	-	+	+	+	+	Ref JAM001 Group Cobb_S
41	22:38:59	20251027-1642-B400_B.14-41	14	H1_C13_HSQCed_Night	g51050xx	-	+	-	-	-	+	+	Ref xxt-18 Group Gardiner_J
41	22:20:24	20251027-1642-B400_B.14-41	13	H1_C13_HMBC_US_Night	g51050xx	-	+	-	-	-	+	+	Ref xxt-18 Group Gardiner_J
41	22:16:08	20251027-1642-B400_B.14-41	12	H1_Night	g51050xx	+	+	-	+	+	+	+	Ref xxt-18 Group Gardiner_J
34	21:59:23	20251027-1601-B400_B.14-34	11	C13_CPD_Night256	p10102hz	+	+	-	+	+	+	+	Ref zhb-a-125b-2 Group Procter_D	sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
33	21:42:41	20251027-1601-B400_B.14-33	11	C13_CPD_Night256	p10102hz	+	+	-	+	+	+	+	Ref zhb-a-125b-1 Group Procter_D	sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
32	21:26:00	20251027-1601-B400_B.14-32	11	C13_CPD_Night256	p10102hz	+	+	-	+	+	+	+	Ref zhb-a-125a Group Procter_D	sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
21	21:25:41	20251027-1427-B400_B.14-21	10	H1_Night128	s77396es	-	-	-	-	-	-	-	Ref ETS52 Group Goodwin_C ETS52_La+Se_long1H_LargeScale
14	21:08:46	20251027-1425-B400_B.14-14	11	C13_CPD_Night256	q62112nk	+	+	-	+	+	+	+	Ref djp-nk-1-234 Group Procter_D	sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
51	19:38:12	20251027-1005-B400_B.14-51	12	H1_Night128	b59259yj	+	+	-	+	+	+	+	Ref MTYJB5_7days Group Turner_M
49	18:50:06	20251027-0956-B400_B.14-49	11	F19_Quant_D35_Night	d93111sd	+	+	-	+	+	+	+	Ref IL-SD-02a Group Larrosa_I	sref: reference peak outside file limits default calibration done, sref: reference peak outside file limits default calibration done
2	18:43:52	20251027-1515-B400_B.14-2	10	H1_Day	z16689fe	+	+	-	+	+	+	+	Ref DJP FE 061 (other fraction) Group Procter_D
1	18:39:17	20251027-1620-B400_B.14-1	10	H1_Day	f09303eg	+	+	-	+	+	+	+	Ref EG03 few drops MeOD Group Webb_S
53	18:34:15	20251027-1741-B400_B.14-53	10	H1_Day	n29715ss	+	+	-	+	+	+	+	Ref DJP-SS-21collective Group Procter_D
50	18:29:31	20251027-1727-B400_B.14-50	10	H1_Day	w52164bc	+	+	-	+	+	+	+	Ref BC-11-144 mixed Group James_M
48	18:25:01	20251027-1726-B400_B.14-48	10	H1_Day	w52164bc	+	+	-	+	+	+	+	Ref BC-11-142 P1 Group James_M
47	18:20:46	20251027-1726-B400_B.14-47	10	H1_Day	w52164bc	+	+	-	+	+	+	+	Ref BC-11-142 P2 Group James_M
46	18:18:28	20251027-1717-B400_B.14-46	12	P31_CPD_Day	g23544jd	-	+	-	-	-	+	+	Ref MJJ-JDL-06-002-3 t=0 Group James_M	sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0
46	18:13:41	20251027-1717-B400_B.14-46	11	F19_Quant_D1_8s_Day	g23544jd	-	+	-	-	-	+	+	Ref MJJ-JDL-06-002-3 t=0 Group James_M	sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0
46	18:09:28	20251027-1717-B400_B.14-46	10	H1_Quant_NS1_Day	g23544jd	+	+	-	+	+	+	+	Ref MJJ-JDL-06-002-3 t=0 Group James_M
45	18:06:59	20251027-1717-B400_B.14-45	12	P31_CPD_Day	g23544jd	-	+	-	-	-	+	+	Ref MJJ-JDL-06-002-2 t=0 Group James_M	sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0
45	18:02:06	20251027-1717-B400_B.14-45	11	F19_Quant_D1_8s_Day	g23544jd	-	+	-	-	-	+	+	Ref MJJ-JDL-06-002-2 t=0 Group James_M	sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0
45	17:56:32	20251027-1717-B400_B.14-45	10	H1_Quant_NS1_Day	g23544jd	+	+	-	+	+	+	+	Ref MJJ-JDL-06-002-2 t=0 Group James_M
44	17:43:24	20251027-1710-B400_B.14-44	10	F19_Quant_D1_8s_Day	q62112nk	+	+	-	+	+	+	+	Ref djp-nk-1-200-US Group Procter_D	sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0
43	17:38:55	20251027-1708-B400_B.14-43	10	H1_Day	a15978el	+	+	-	+	+	+	+	Ref EL-04-059 f22-29 Group James_M
42	17:34:35	20251027-1643-B400_B.14-42	10	H1_Day	b26045ab	+	+	-	+	+	+	+	Ref AT-ABO-02-540-cr Group Trowbridge_A
41	17:28:19	20251027-1642-B400_B.14-41	11	H1_COSY_Day	g51050xx	-	+	-	-	-	+	+	Ref xxt-18 Group Gardiner_J
41	17:24:15	20251027-1642-B400_B.14-41	10	H1_Day	g51050xx	+	+	-	+	+	+	+	Ref xxt-18 Group Gardiner_J
40	17:20:06	20251027-1632-B400_B.14-40	10	H1_Day	mbdxrbj2	+	+	-	+	+	+	+	Ref BJ667_35-38 Group Procter_D
39	17:15:50	20251027-1632-B400_B.14-39	10	H1_Day	mbdxrbj2	+	+	-	+	+	+	+	Ref BJ667_21-34 Group Procter_D
38	17:11:37	20251027-1616-B400_B.14-38	10	H1_Day	b32507dt	+	+	-	+	+	+	+	Ref dtgb128b Group Webb_S
37	17:06:40	20251027-1616-B400_B.14-37	10	H1_Day	b32507dt	+	+	-	+	+	+	+	Ref dtgb128a Group Webb_S
36	17:01:58	20251027-1611-B400_B.14-36	10	H1_Day	z88883sp	+	+	-	+	+	+	+	Ref SP381c Group Romanov_A Fr 7-9
35	16:55:42	20251027-1603-B400_B.14-35	11	H1_COSY_Day	z40973rs	-	+	-	-	-	+	+	Ref gdb-rs-144 crude Group DeBo_G
35	16:50:49	20251027-1603-B400_B.14-35	10	H1_Day	z40973rs	+	+	-	+	+	+	+	Ref gdb-rs-144 crude Group DeBo_G
34	16:46:18	20251027-1601-B400_B.14-34	10	H1_Day	p10102hz	+	+	-	+	+	+	+	Ref zhb-a-125b-2 Group Procter_D
33	16:41:49	20251027-1601-B400_B.14-33	10	H1_Day	p10102hz	+	+	-	+	+	+	+	Ref zhb-a-125b-1 Group Procter_D
32	16:37:19	20251027-1601-B400_B.14-32	10	H1_Day	p10102hz	+	+	-	+	+	+	+	Ref zhb-a-125a Group Procter_D
31	16:32:12	20251027-1526-B400_B.14-31	10	H1_Day	mbdxrjr4	+	+	-	+	+	+	+	Ref MFG-JR-005-B Group Greaney_M
30	16:27:34	20251027-1547-B400_B.14-30	10	H1_Day	u50028ip	+	+	-	+	+	+	+	Ref N acetyl redox active ester Group Larrosa_I
29	16:22:30	20251027-1547-B400_B.14-29	11	F19_Quant_D1_8s_Day	u50028ip	-	+	-	-	-	+	+	Ref NP-rr urea CF3 Group Larrosa_I	sref: NUCLEUS '19F' not defined for SOLVENT 'DMSO' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'DMSO' SR is set to 0.0
29	16:18:16	20251027-1547-B400_B.14-29	10	H1_Day	u50028ip	+	+	-	+	+	+	+	Ref NP-rr urea CF3 Group Larrosa_I
28	16:12:56	20251027-1546-B400_B.14-28	10	H1_Day	t91715jk	+	+	-	+	+	+	+	Ref TP002 t0 in chloro Group Gibson_M TP002 t0 in chloro
27	16:10:04	20251027-1535-B400_B.14-27	12	F19_NoCPD_Day	c62220rg	-	+	-	-	-	+	+	Ref at-rg- 4ome cat Group Trowbridge_A	sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0
27	16:07:36	20251027-1535-B400_B.14-27	11	P31_Wide_Day	c62220rg	-	+	-	-	-	+	+	Ref at-rg- 4ome cat Group Trowbridge_A	sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0
27	16:02:24	20251027-1535-B400_B.14-27	10	H1_Day	c62220rg	+	+	-	+	+	+	+	Ref at-rg- 4ome cat Group Trowbridge_A
26	15:57:35	20251027-1534-B400_B.14-26	10	H1_Day	z88883sp	+	+	-	+	+	+	+	Ref SP379e Group Romanov_A Petrol washings
25	15:52:51	20251027-1533-B400_B.14-25	10	H1_Day	z88883sp	+	+	-	+	+	+	+	Ref SP381b Group Romanov_A Column fr 4-6
24	15:48:17	20251027-1522-B400_B.14-24	10	H1_Day	g2777ec	+	+	-	+	+	+	+	Ref RWEC-I-126-2b Group Winpenny_R
23	15:43:10	20251027-1521-B400_B.14-23	10	H1_Day	g2777ec	+	+	-	+	+	+	+	Ref RWEC-I-126-2a Group Winpenny_R
22	15:38:00	20251027-1519-B400_B.14-22	10	H1_Quant_NS1_Day	z86427mk	+	+	-	+	+	+	+	Ref MK-248 Group Procter_D
20	15:33:46	20251027-1519-B400_B.14-20	10	H1_Day	z86427mk	+	+	-	+	+	+	+	Ref MK-247-B F15-16 Group Procter_D
19	15:29:02	20251027-1519-B400_B.14-19	10	H1_Day	z86427mk	+	+	-	+	+	+	+	Ref MK-247-B F13-14 Group Procter_D
18	15:24:20	20251027-1517-B400_B.14-18	10	H1_Day	g16660ml	+	+	-	+	+	+	+	Ref djp-muze Group Procter_D
17	15:15:18	20251027-1448-B400_B.14-17	10	H1_Day	f85241bm	+	+	-	+	x	+	+	Ref BM999-1 Group Bures_J	topshim: TopshimWaitForEvent - acquisition completed : timeout after 320 sec, Shim failed
16	15:10:31	20251027-1446-B400_B.14-16	11	F19_Quant_D1_8s_Day	u50028ip	-	+	-	-	-	+	+	Ref Urea QUinoline CONH Group Larrosa_I	sref: NUCLEUS '19F' not defined for SOLVENT 'DMSO' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'DMSO' SR is set to 0.0
16	15:06:26	20251027-1446-B400_B.14-16	10	H1_Day	u50028ip	+	+	-	+	+	+	+	Ref Urea QUinoline CONH Group Larrosa_I
15	15:02:07	20251027-1444-B400_B.14-15	10	H1_Day	y52364mw	+	+	-	+	+	+	+	Ref GDB-MJ-317-t1 Group DeBo_G
14	14:57:36	20251027-1425-B400_B.14-14	10	H1_Day	q62112nk	+	+	-	+	+	+	+	Ref djp-nk-1-234 Group Procter_D
13	14:49:22	20251027-1424-B400_B.14-13	10	F19_Quant_D1_8s_Day	q62112nk	+	+	-	+	+	+	+	Ref djp-nk-1-233-2 Group Procter_D	sref: NUCLEUS '19F' not defined for SOLVENT 'DMSO' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'DMSO' SR is set to 0.0
12	14:21:58	20251027-1420-B400_B.14-12	10	F19_NoCPD_Day	q62112nk	-	-	-	-	-	-	-	Ref djp-nk-1-200us Group Procter_D
11	14:17:32	20251027-1416-B400_B.14-11	10	H1_Day	m09677nb	+	+	-	+	+	+	+	Ref 3ph za Group Greaney_M
6	14:11:53	20251027-1409-B400_B.14-6	10	H1_Day	g2777ec	+	+	-	+	+	+	+	Ref RWEC-I-126-2 Group Winpenny_R
5	14:07:32	20251027-1407-B400_B.14-5	10	H1_Day	z88883sp	+	+	-	+	+	+	+	Ref SP379d Group Romanov_A Petrol insoluble
4	13:47:29	20251027-1347-B400_B.14-4	10	H1_Day	e02956op	+	+	-	+	+	+	+	Ref GDB-OP0346_A-1H_CDCl3 Group DeBo_G
1	13:26:02	20251027-1115-B400_B.14-1	10	H1_Day	z16689fe	+	+	-	+	+	+	+	Ref DJP FE 061 (columned) Group Procter_D
19	13:21:32	20251027-1306-B400_B.14-19	10	H1_Day	b32507dt	+	+	-	+	+	+	+	Ref dtgb135 fin Group Webb_S
18	13:19:59	20251027-1242-B400_B.14-18	11	Al27_Day	j20588jh	-	+	-	-	-	+	+	Ref JH-DW-23.10.1-DippZnAlCl EtNCS Group Willcox_D Oweekend rt	sref: NUCLEUS '27Al' not defined for SOLVENT 'C6D6' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Willcox_D/data/j20588jh/nmr/20251027-1242-B400_B.14-18/11/pdata/1/peaks!, sref: NUCLEUS '27Al' not defined for SOLVENT 'C6D6' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Willcox_D/data/j20588jh/nmr/20251027-1242-B400_B.14-18/11/pdata/1/peaks!
18	13:16:00	20251027-1242-B400_B.14-18	10	H1_Day	j20588jh	+	+	-	+	+	+	+	Ref JH-DW-23.10.1-DippZnAlCl EtNCS Group Willcox_D Oweekend rt
17	13:14:04	20251027-1242-B400_B.14-17	11	Al27_Day	j20588jh	-	+	-	-	-	+	+	Ref JH-DW-23.11.1-DippZnAlCl (CF3)2PhNCS Group Willcox_D Oweekend rt	sref: NUCLEUS '27Al' not defined for SOLVENT 'C6D6' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Willcox_D/data/j20588jh/nmr/20251027-1242-B400_B.14-17/11/pdata/1/peaks!, sref: NUCLEUS '27Al' not defined for SOLVENT 'C6D6' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Willcox_D/data/j20588jh/nmr/20251027-1242-B400_B.14-17/11/pdata/1/peaks!
17	13:10:03	20251027-1242-B400_B.14-17	10	H1_Day	j20588jh	+	+	-	+	+	+	+	Ref JH-DW-23.11.1-DippZnAlCl (CF3)2PhNCS Group Willcox_D Oweekend rt
16	13:05:53	20251027-1221-B400_B.14-16	10	H1_Day	c15204fs	+	+	-	+	+	+	+	Ref GDB-FS001Fr28 Group DeBo_G
15	13:01:42	20251027-1220-B400_B.14-15	10	H1_Day	c15204fs	+	+	-	+	+	+	+	Ref GDB-FS001Fr11 Group DeBo_G
14	12:57:46	20251027-1205-B400_B.14-14	11	F19_CPD_Day	w52164bc	-	+	-	-	-	+	+	Ref BC-11-144 crude Group James_M	sref: NUCLEUS '19F' not defined for SOLVENT 'MeOD' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'MeOD' SR is set to 0.0
14	12:53:45	20251027-1205-B400_B.14-14	10	H1_Day	w52164bc	+	+	-	+	+	+	+	Ref BC-11-144 crude Group James_M
13	12:51:01	20251027-1205-B400_B.14-13	11	F19_CPD_Day	w52164bc	-	+	-	-	-	+	+	Ref BC-11-142 Group James_M	sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0
13	12:42:06	20251027-1205-B400_B.14-13	10	H1_Day	w52164bc	+	+	-	+	x	+	+	Ref BC-11-142 Group James_M	topshim: TopshimWaitForEvent - acquisition completed : timeout after 320 sec, Shim failed
12	12:37:49	20251027-1149-B400_B.14-12	10	H1_Day	j53590ed	+	+	-	+	+	+	+	Ref ED1-001_crude Group Greaney_M
10	12:32:25	20251027-1138-B400_B.14-10	10	H1_Day	mbdxrjr4	+	+	-	+	+	+	+	Ref MFG-JR-005-C Group Greaney_M
9	12:11:43	20251027-1147-B400_B.14-9	11	Si29_CPD_Day	mbdxkrn2	-	-	-	-	-	-	-	Ref GDB-RN Triphenylchlorosilane formation crude - Acetone-d6 Group DeBo_G
9	12:06:58	20251027-1147-B400_B.14-9	10	H1_Day	mbdxkrn2	+	+	-	+	+	+	+	Ref GDB-RN Triphenylchlorosilane formation crude - Acetone-d6 Group DeBo_G
8	11:58:56	20251027-1156-B400_B.14-8	10	F19_Quant_D1_8s_Day	c62220rg	+	+	-	+	+	+	+	Ref at-rg-5-12-c1 Group Trowbridge_A	sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0
7	11:11:16	20251027-0949-B400_B.14-7	11	F19_Quant_D35_Night	d93111sd	+	+	-	+	+	+	+	Ref IL-SD-1b Group Larrosa_I	sref: NUCLEUS '19F' not defined for SOLVENT 'DMSO' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'DMSO' SR is set to 0.0
52	11:10:59	20251027-1005-B400_B.14-52	11	C13_CPD_Night256	b59259yj	-	-	-	-	-	-	-	Ref MTYJB6_102hr Group Turner_M
56	11:06:54	20251027-1048-B400_B.14-56	10	H1_Day	j20588jh	+	+	-	+	+	+	+	Ref JH-DW-23.09.1-DippZnAlCl CyNCO Group Willcox_D +4 days rt
55	11:02:55	20251027-1047-B400_B.14-55	10	H1_Day	j20588jh	+	+	-	+	+	+	+	Ref JH-DW-23.08.1-DippZnAlCl AdNCS Group Willcox_D +6 days rt
54	10:58:18	20251027-1047-B400_B.14-54	10	H1_Day	j20588jh	+	+	-	+	+	+	+	Ref JH-DW-26.08.4-DippZnAlCl TMSN3 Group Willcox_D + 4 days rt
53	10:53:08	20251027-1046-B400_B.14-53	10	H1_Day	b32507dt	+	+	-	+	+	+	+	Ref dtgb135 col Group Webb_S
51	10:31:44	20251027-1005-B400_B.14-51	11	C13_CPD_Night256	b59259yj	+	+	-	+	x	+	+	Ref MTYJB5_7days Group Turner_M	topshim: TopshimWaitForEvent - acquisition completed : timeout after 320 sec, Shim failed, sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
53	10:27:34	20251027-1011-B400_B.14-53	10	H1_Day	x73847lm	+	+	-	+	+	+	+	Ref IR-LJM-01-119.3 Group Riddell_I
52	10:22:50	20251027-1005-B400_B.14-52	10	H1_Day	b59259yj	+	+	-	+	+	+	+	Ref MTYJB6_102hr Group Turner_M
51	10:17:53	20251027-1005-B400_B.14-51	10	H1_Day	b59259yj	+	+	-	+	+	+	+	Ref MTYJB5_7days Group Turner_M
50	10:15:24	20251027-1003-B400_B.14-50	11	P31_CPD_Day	f25045cc	-	+	-	-	-	+	+	Ref CJC-DW-3-rerunewk5 Group Willcox_D	sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0
50	10:10:04	20251027-1003-B400_B.14-50	10	H1_Day	f25045cc	+	+	-	+	+	+	+	Ref CJC-DW-3-rerunewk5 Group Willcox_D
49	10:05:10	20251027-0956-B400_B.14-49	10	H1_Day	d93111sd	+	+	-	+	+	+	+	Ref IL-SD-02a Group Larrosa_I
7	10:00:55	20251027-0949-B400_B.14-7	10	H1_Day	d93111sd	+	+	-	+	+	+	+	Ref IL-SD-1b Group Larrosa_I
6	09:50:02	20251027-0943-B400_B.14-6	11	Se77_Day	s77396es	-	+	-	-	-	+	+	Ref ETS52 Group Goodwin_C ETS52_La+Se_largeScale_77Se_morning	sref: NUCLEUS '77Se' not defined for SOLVENT 'C6D6' SR is set to 0.0, sref: NUCLEUS '77Se' not defined for SOLVENT 'C6D6' SR is set to 0.0
6	09:45:37	20251027-0943-B400_B.14-6	10	H1_Day	s77396es	+	+	-	+	+	+	+	Ref ETS52 Group Goodwin_C ETS52_La+Se_largeScale_1H_morning
38	09:25:43	20251027-0858-B400_B.14-38	10	H1_Wide_Day	b50715cd	+	+	-	+	-	+	+	Ref BuLi titration Group Goodwin_C 1H	pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Goodwin_C/data/b50715cd/nmr/20251027-0858-B400_B.14-38/10/pdata/1/peaks!, pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Goodwin_C/data/b50715cd/nmr/20251027-0858-B400_B.14-38/10/pdata/1/peaks!
37	09:20:54	20251027-0846-B400_B.14-37	11	F19_Quant_D1_8s_Day	u50028ip	-	+	-	-	-	+	+	Ref Pcyene Squaramidee KOAc 95 C 2 dias Group Larrosa_I	sref: reference peak outside file limits default calibration done, sref: reference peak outside file limits default calibration done
37	09:16:37	20251027-0846-B400_B.14-37	10	H1_Day	u50028ip	+	+	-	+	+	+	+	Ref Pcyene Squaramidee KOAc 95 C 2 dias Group Larrosa_I
36	09:10:59	20251027-0846-B400_B.14-36	11	F19_Quant_D1_8s_Day	u50028ip	-	+	-	-	-	+	+	Ref Ruaqua Squaramidee KOAc 95 C 2 dias Group Larrosa_I	sref: reference peak outside file limits default calibration done, sref: reference peak outside file limits default calibration done
36	09:06:45	20251027-0846-B400_B.14-36	10	H1_Day	u50028ip	+	+	-	+	+	+	+	Ref Ruaqua Squaramidee KOAc 95 C 2 dias Group Larrosa_I
35	09:01:25	20251027-0846-B400_B.14-35	11	F19_Quant_D1_8s_Day	u50028ip	-	+	-	-	-	+	+	Ref Pcymene antracene KOAc 95 C 2 dias Group Larrosa_I	sref: reference peak outside file limits default calibration done, sref: reference peak outside file limits default calibration done
35	08:57:10	20251027-0846-B400_B.14-35	10	H1_Day	u50028ip	+	+	-	+	+	+	+	Ref Pcymene antracene KOAc 95 C 2 dias Group Larrosa_I
34	08:51:52	20251027-0846-B400_B.14-34	11	F19_Quant_D1_8s_Day	u50028ip	-	+	-	-	-	+	+	Ref Ruaqua antracene KOAc 95 C 2 dias Group Larrosa_I	sref: reference peak outside file limits default calibration done, sref: reference peak outside file limits default calibration done
34	08:47:10	20251027-0846-B400_B.14-34	10	H1_Day	u50028ip	+	+	-	+	+	+	+	Ref Ruaqua antracene KOAc 95 C 2 dias Group Larrosa_I
20	08:29:02	20251027-0828-B400_B.14-20	10	H1_Day	z40241jm	+	+	-	+	+	+	+	Ref DJP-JIM-7-128-0 Group Procter_D
1	08:15:29	20251027-0815-B400_B.14-1	10	H1_Day	z16689fe	+	+	-	+	+	+	+	Ref DJP FE 061 (crude) Group Procter_D
5	00:04:48	20251026-2329-B400_B.14-5	12	C13_DEPT135_Night	a74776dr	-	+	-	-	-	+	+	Ref DJP-DR-1-375-cr Group Procter_D	sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
5	23:50:15	20251026-2329-B400_B.14-5	11	C13_CPD_Night256	a74776dr	-	+	-	-	-	+	+	Ref DJP-DR-1-375-cr Group Procter_D	sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
5	23:45:55	20251026-2329-B400_B.14-5	10	H1_Night	a74776dr	+	+	-	+	+	+	+	Ref DJP-DR-1-375-cr Group Procter_D
4	23:27:30	20251026-1831-B400_B.14-4	15	H1_C13_HMBC_US_Night	z40241jm	-	+	-	-	-	+	+	Ref DJP-JIM-7-122-3a-spot2-fullchar Group Procter_D
4	23:03:53	20251026-1831-B400_B.14-4	14	H1_C13_HSQCed_Night	z40241jm	-	+	-	-	-	+	+	Ref DJP-JIM-7-122-3a-spot2-fullchar Group Procter_D
4	22:52:02	20251026-1831-B400_B.14-4	13	H1_COSY_HiRes_Night	z40241jm	-	+	-	-	-	+	+	Ref DJP-JIM-7-122-3a-spot2-fullchar Group Procter_D
4	22:43:26	20251026-1831-B400_B.14-4	12	C13_DEPT135_Night	z40241jm	-	+	-	-	-	+	+	Ref DJP-JIM-7-122-3a-spot2-fullchar Group Procter_D
4	22:29:00	20251026-1831-B400_B.14-4	11	C13_CPD_Night256	z40241jm	-	+	-	-	-	+	+	Ref DJP-JIM-7-122-3a-spot2-fullchar Group Procter_D
4	22:24:32	20251026-1831-B400_B.14-4	10	H1_Night	z40241jm	+	+	-	+	+	+	+	Ref DJP-JIM-7-122-3a-spot2-fullchar Group Procter_D
3	19:57:35	20251026-1831-B400_B.14-3	15	H1_C13_HMBC_US_Night	z40241jm	-	+	-	-	-	+	+	Ref DJP-JIM-7-122-3a-spot1-fullchar Group Procter_D
3	19:33:56	20251026-1831-B400_B.14-3	14	H1_C13_HSQCed_Night	z40241jm	-	+	-	-	-	+	+	Ref DJP-JIM-7-122-3a-spot1-fullchar Group Procter_D
3	19:22:06	20251026-1831-B400_B.14-3	13	H1_COSY_HiRes_Night	z40241jm	-	+	-	-	-	+	+	Ref DJP-JIM-7-122-3a-spot1-fullchar Group Procter_D
3	19:13:38	20251026-1831-B400_B.14-3	12	C13_DEPT135_Night	z40241jm	-	+	-	-	-	+	+	Ref DJP-JIM-7-122-3a-spot1-fullchar Group Procter_D
3	18:58:42	20251026-1831-B400_B.14-3	11	C13_CPD_Night256	z40241jm	-	+	-	-	-	+	+	Ref DJP-JIM-7-122-3a-spot1-fullchar Group Procter_D
3	18:54:17	20251026-1831-B400_B.14-3	10	H1_Night	z40241jm	+	+	-	+	+	+	+	Ref DJP-JIM-7-122-3a-spot1-fullchar Group Procter_D
4	18:36:49	20251026-1831-B400_B.14-4	10	H1_Day	z40241jm	+	+	-	+	+	+	+	Ref DJP-JIM-7-122-3a-spot2 Group Procter_D
3	18:32:09	20251026-1831-B400_B.14-3	10	H1_Day	z40241jm	+	+	-	+	+	+	+	Ref DJP-JIM-7-122-3a-spot1 Group Procter_D
2	18:02:46	20251026-1753-B400_B.14-2	10	H1_WaterSupp_Day	k56390qs	+	+	-	+	+	+	+	Ref 1002-2 Group Schroder_M	sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
1	18:00:30	20251026-1750-B400_B.14-1	12	H1_Day	b72547am	-	+	-	-	-	+	+	Ref 5-22 R2 R4 after Si Plug Group Larrosa_I
1	17:55:39	20251026-1750-B400_B.14-1	11	F19_Quant_D1_8s_Day	b72547am	-	+	-	-	-	+	+	Ref 5-22 R2 R4 after Si Plug Group Larrosa_I	sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0
1	17:51:17	20251026-1750-B400_B.14-1	10	F19_NoCPD_Day	b72547am	+	+	-	+	+	+	+	Ref 5-22 R2 R4 after Si Plug Group Larrosa_I	sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0
21	16:52:05	20251026-1619-B400_B.14-21	12	P31_CPD_Day	w81612cw	-	+	-	-	-	+	+	Ref Il-CKW-PJ3-159 ppt 31P Group Mehta_M	sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0
21	16:41:43	20251026-1619-B400_B.14-21	11	F19_CPD_Day	w81612cw	-	+	-	-	-	+	+	Ref Il-CKW-PJ3-159 ppt 19F Group Mehta_M	sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0
21	16:36:59	20251026-1619-B400_B.14-21	10	H1_Day	w81612cw	+	+	-	+	+	+	+	Ref Il-CKW-PJ3-159 ppt 1H Group Mehta_M
20	16:32:00	20251026-1618-B400_B.14-20	10	H1_Day	b59259yj	+	+	-	+	+	+	+	Ref MTYJ_B6_96h Group Turner_M
19	16:27:33	20251026-1600-B400_B.14-19	10	H1_Quant_NS1_Day	a74776dr	+	+	-	+	+	+	+	Ref DJP-DR-1-377-cr Group Procter_D
18	16:03:56	20251026-1536-B400_B.14-18	14	H1_C13_HSQCed_Night	n31353oc	-	+	-	-	-	+	+	Ref djp-oc-858-is-dmso Group Procter_D
18	15:45:12	20251026-1536-B400_B.14-18	13	H1_C13_HMBC_US_Night	n31353oc	-	+	-	-	-	+	+	Ref djp-oc-858-is-dmso Group Procter_D
18	15:43:01	20251026-1536-B400_B.14-18	12	H1_Night	n31353oc	-	+	-	-	-	+	+	Ref djp-oc-858-is-dmso Group Procter_D
18	15:40:53	20251026-1536-B400_B.14-18	11	H1_Quant_NS1_Day	n31353oc	-	+	-	-	-	+	+	Ref djp-oc-858-is-dmso Group Procter_D
18	15:37:01	20251026-1536-B400_B.14-18	10	H1_Day	n31353oc	+	+	-	+	+	+	+	Ref djp-oc-858-is-dmso Group Procter_D
18	14:31:03	20251026-1430-B400_B.14-18	10	H1_Day	n31353oc	+	+	-	+	+	+	+	Ref djp-oc-856-sub-is Group Procter_D
7	14:10:54	20251025-1758-B400_B.14-7	10	H1_Day	t13367jb	+	+	-	+	+	+	+	Ref mfg-jb-05-043-pc4 Group Greaney_M mfg-jb-05-043-pc4
3	14:09:10	20251025-1904-B400_B.14-3	10	H1_Day	u67812sg	-	-	-	-	-	+	+	Ref sq-01-168-3 Group Procter_D
3	19:09:31	20251025-1904-B400_B.14-3	10	H1_Day	u67812sg	+	+	-	x	-	-	-	Ref sq-01-168-3 Group Procter_D	Lock failed after multiple attempts, lock: Command 'lock CDCl3' failed. Lock is OFF BSMS can't detect sample! Sample is MISSING Check SPIN and/or VTU gasflow!, Command 'lock CDCl3' failed. Lock is OFF BSMS can't detect sample! Sample is MISSING Check SPIN and/or VTU gasflow!
2	19:07:09	20251025-1904-B400_B.14-2	10	H1_Day	u67812sg	+	+	-	x	-	-	-	Ref sq-01-168-2 Group Procter_D	Lock failed after multiple attempts, lock: Command 'lock CDCl3' failed. Lock is OFF BSMS can't detect sample! Sample is MISSING Check SPIN and/or VTU gasflow!, Command 'lock CDCl3' failed. Lock is OFF BSMS can't detect sample! Sample is MISSING Check SPIN and/or VTU gasflow!
1	19:04:37	20251025-1904-B400_B.14-1	10	H1_Day	u67812sg	+	+	-	x	-	-	-	Ref sq-01-168-1 Group Procter_D	Lock failed after multiple attempts, lock: Command 'lock CDCl3' failed. Lock is OFF BSMS can't detect sample! Sample is MISSING Check SPIN and/or VTU gasflow!, Command 'lock CDCl3' failed. Lock is OFF BSMS can't detect sample! Sample is MISSING Check SPIN and/or VTU gasflow!
46	18:40:56	20251025-1810-B400_B.14-46	11	C13_CPD_Night256	z40241jm	-	+	-	-	-	+	+	Ref DJP-JIM-7-111-2a-fullchar Group Procter_D	pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Procter_D/data/z40241jm/nmr/20251025-1810-B400_B.14-46/11/pdata/1/peaks!, pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Procter_D/data/z40241jm/nmr/20251025-1810-B400_B.14-46/11/pdata/1/peaks!
46	18:37:51	20251025-1810-B400_B.14-46	10	H1_Day	z40241jm	+	+	-	+	-	+	+	Ref DJP-JIM-7-111-2a-fullchar Group Procter_D	pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Procter_D/data/z40241jm/nmr/20251025-1810-B400_B.14-46/10/pdata/1/peaks!, pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Procter_D/data/z40241jm/nmr/20251025-1810-B400_B.14-46/10/pdata/1/peaks!
47	18:14:09	20251025-1811-B400_B.14-47	10	H1_Day	z40241jm	+	+	-	x	-	-	-	Ref DJP-JIM-7-115-2a-scaleup-fullchar Group Procter_D	Lock failed after multiple attempts, lock: Command 'lock CDCl3' failed. Lock is PENDING BSMS can't detect sample! Sample is MISSING Check SPIN and/or VTU gasflow!, Command 'lock CDCl3' failed. Lock is PENDING BSMS can't detect sample! Sample is MISSING Check SPIN and/or VTU gasflow!
46	18:11:14	20251025-1810-B400_B.14-46	10	H1_Day	z40241jm	+	+	-	x	-	-	-	Ref DJP-JIM-7-111-2a-fullchar Group Procter_D	Lock failed after multiple attempts, lock: Command 'lock CDCl3' failed. Lock is PENDING BSMS can't detect sample! Sample is MISSING Check SPIN and/or VTU gasflow!, Command 'lock CDCl3' failed. Lock is PENDING BSMS can't detect sample! Sample is MISSING Check SPIN and/or VTU gasflow!
7	17:58:47	20251025-1758-B400_B.14-7	10	H1_Day	t13367jb	+	+	-	x	-	-	-	Ref mfg-jb-05-043-pc4 Group Greaney_M mfg-jb-05-043-pc4	Lock failed after multiple attempts, lock: Command 'lock CDCl3' failed. Lock is PENDING BSMS can't detect sample! Sample is MISSING Check SPIN and/or VTU gasflow!, Command 'lock CDCl3' failed. Lock is PENDING BSMS can't detect sample! Sample is MISSING Check SPIN and/or VTU gasflow!
6	17:52:19	20251025-1748-B400_B.14-6	10	H1_Day	t13367jb	+	+	-	+	+	+	+	Ref mfg-jb-05-043-pc2 Group Greaney_M mfg-jb-05-043-pc2
5	17:47:30	20251025-1746-B400_B.14-5	10	H1_Day	t13367jb	+	+	-	+	+	+	+	Ref mfg-jb-05-043-c Group Greaney_M mfg-jb-05-043-c
4	17:33:50	20251025-1729-B400_B.14-4	10	H1_Day	b26045ab	+	+	-	+	+	+	+	Ref AT-ABO-02-541cr Group Trowbridge_A
3	17:29:17	20251025-1728-B400_B.14-3	10	H1_Day	b26045ab	+	+	-	+	+	+	+	Ref AT-ABO-02-540cr Group Trowbridge_A
2	17:16:31	20251025-1710-B400_B.14-2	10	H1_Day	n29715ss	+	+	-	+	+	+	+	Ref DJP-SS-20silicafilter Group Procter_D
1	17:11:52	20251025-1710-B400_B.14-1	10	H1_Day	n29715ss	+	+	-	+	+	+	+	Ref DJP-SS-20Mgso4filter Group Procter_D
47	16:53:39	20251025-1649-B400_B.14-47	10	H1_Day	z40241jm	+	+	-	+	+	+	+	Ref DJP-JIM-7-115-2a-scaleup Group Procter_D
46	16:49:16	20251025-1648-B400_B.14-46	10	H1_Day	z40241jm	+	+	-	+	+	+	+	Ref DJPO-JIM-111-2a-scale-up Group Procter_D
4	16:43:39	20251025-1625-B400_B.14-4	11	F19_CPD_Day	b72547am	-	+	-	-	-	+	+	Ref 5-19 ovn 55c Group Larrosa_I	sref: NUCLEUS '19F' not defined for SOLVENT 'C6D6' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'C6D6' SR is set to 0.0
4	16:36:49	20251025-1625-B400_B.14-4	10	F19_Quant_D1_8s_Day	b72547am	+	+	-	+	+	+	+	Ref 5-19 ovn 55c Group Larrosa_I	sref: NUCLEUS '19F' not defined for SOLVENT 'C6D6' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'C6D6' SR is set to 0.0
3	16:34:22	20251025-1625-B400_B.14-3	11	F19_CPD_Day	b72547am	-	+	-	-	-	+	+	Ref 5-18 ovn 55C Group Larrosa_I	sref: NUCLEUS '19F' not defined for SOLVENT 'C6D6' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'C6D6' SR is set to 0.0
3	16:26:23	20251025-1625-B400_B.14-3	10	F19_Quant_D1_8s_Day	b72547am	+	+	-	+	+	+	+	Ref 5-18 ovn 55C Group Larrosa_I	sref: NUCLEUS '19F' not defined for SOLVENT 'C6D6' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'C6D6' SR is set to 0.0
2	16:22:14	20251025-1621-B400_B.14-2	10	H1_Quant_NS1_Day	a74776dr	+	+	-	+	+	+	+	Ref DJP-DR-1-373-cr Group Procter_D
1	15:14:42	20251025-1513-B400_B.14-1	10	H1_Day	n29715ss	+	+	-	+	+	+	+	Ref DJP-SS-doublecheckbase1hour Group Procter_D
18	15:03:26	20251025-1458-B400_B.14-18	11	H1_Quant_NS1_Day	n31353oc	-	+	-	-	-	+	+	Ref djp-oc-856-is-dmso Group Procter_D
18	14:59:25	20251025-1458-B400_B.14-18	10	H1_Day	n31353oc	+	+	-	+	+	+	+	Ref djp-oc-856-is-dmso Group Procter_D
1	14:16:29	20251025-1415-B400_B.14-1	10	H1_Day	n29715ss	+	+	-	+	+	+	+	Ref DJP-SS-doublecheckbase Group Procter_D
3	13:39:28	20251025-1329-B400_B.14-3	10	H1_Day	n29715ss	+	+	-	+	+	+	+	Ref DJP-SS-19 Group Procter_D
2	13:35:00	20251025-1329-B400_B.14-2	10	H1_Day	n29715ss	+	+	-	+	+	+	+	Ref DJP-SS-base1hour Group Procter_D
1	13:30:29	20251025-1329-B400_B.14-1	10	H1_Day	n29715ss	+	+	-	+	+	+	+	Ref DJP-SS-nobase1hour Group Procter_D
19	13:14:22	20251025-1308-B400_B.14-19	10	H1_Day	h68355ac	+	+	-	+	+	+	+	Ref MFG-AC-659 Group Greaney_M
18	13:09:50	20251025-1308-B400_B.14-18	10	H1_Day	h68355ac	+	+	-	+	+	+	+	Ref MFG-AC-658 Group Greaney_M
1	12:53:22	20251025-1248-B400_B.14-1	10	H1_Day	n29715ss	+	+	-	+	+	+	+	Ref DJP-SS-nobasecheck30minlater Group Procter_D
2	12:49:18	20251025-1248-B400_B.14-2	10	H1_Day	n29715ss	+	+	-	+	+	+	+	Ref DJP-SS-basecheck30minlater Group Procter_D
2	12:06:49	20251025-1201-B400_B.14-2	10	H1_Day	n29715ss	+	+	-	+	+	+	+	Ref DJP-SS-checkbase Group Procter_D
1	12:02:23	20251025-1200-B400_B.14-1	10	H1_Day	n29715ss	+	+	-	+	+	+	+	Ref DJP-SS-checknobase Group Procter_D
55	11:17:09	20251024-1746-B400_B.14-55	13	H1_WaterSupp_Night	b72547am	-	+	-	-	-	+	+	Ref 5-10R2 ovn 50C Group Larrosa_I	autophase: Command 'autophase' only possible with locked sample! Current LOCK Status is OFF, pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Larrosa_I/data/b72547am/nmr/20251024-1746-B400_B.14-55/13/pdata/1/peaks!, pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Larrosa_I/data/b72547am/nmr/20251024-1746-B400_B.14-55/13/pdata/1/peaks!
55	11:10:19	20251024-1746-B400_B.14-55	12	F19_NoCPD_Night	b72547am	-	+	-	-	-	+	+	Ref 5-10R2 ovn 50C Group Larrosa_I
55	10:25:05	20251024-1746-B400_B.14-55	11	F19_Quant_D35_Night	b72547am	-	+	-	-	-	+	+	Ref 5-10R2 ovn 50C Group Larrosa_I
55	10:21:54	20251024-1746-B400_B.14-55	10	H1_Night	b72547am	+	+	-	+	-	+	+	Ref 5-10R2 ovn 50C Group Larrosa_I	pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Larrosa_I/data/b72547am/nmr/20251024-1746-B400_B.14-55/10/pdata/1/peaks!, pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Larrosa_I/data/b72547am/nmr/20251024-1746-B400_B.14-55/10/pdata/1/peaks!
54	10:14:50	20251024-1746-B400_B.14-54	12	F19_NoCPD_Night	b72547am	-	+	-	-	-	+	+	Ref 5-10R1 ovn 50C Group Larrosa_I	sref: reference peak outside file limits default calibration done, sref: reference peak outside file limits default calibration done
54	09:28:42	20251024-1746-B400_B.14-54	11	F19_Quant_D35_Night	b72547am	-	+	-	-	-	+	+	Ref 5-10R1 ovn 50C Group Larrosa_I	sref: reference peak outside file limits default calibration done, sref: reference peak outside file limits default calibration done
54	09:24:25	20251024-1746-B400_B.14-54	10	H1_Night	b72547am	+	+	-	+	+	+	+	Ref 5-10R1 ovn 50C Group Larrosa_I
53	08:51:16	20251024-1746-B400_B.14-53	13	H1_WaterSupp_Night	b72547am	-	+	-	-	-	+	+	Ref 5-9R2 ovn 50C Group Larrosa_I	autophase: Command 'autophase' only possible with locked sample! Current LOCK Status is OFF, pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Larrosa_I/data/b72547am/nmr/20251024-1746-B400_B.14-53/13/pdata/1/peaks!, pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Larrosa_I/data/b72547am/nmr/20251024-1746-B400_B.14-53/13/pdata/1/peaks!
53	08:44:18	20251024-1746-B400_B.14-53	12	F19_NoCPD_Night	b72547am	-	+	-	-	-	+	+	Ref 5-9R2 ovn 50C Group Larrosa_I
53	07:56:45	20251024-1746-B400_B.14-53	11	F19_Quant_D35_Night	b72547am	-	+	-	-	-	+	+	Ref 5-9R2 ovn 50C Group Larrosa_I
53	07:53:32	20251024-1746-B400_B.14-53	10	H1_Night	b72547am	+	+	-	+	-	+	+	Ref 5-9R2 ovn 50C Group Larrosa_I	pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Larrosa_I/data/b72547am/nmr/20251024-1746-B400_B.14-53/10/pdata/1/peaks!, pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Larrosa_I/data/b72547am/nmr/20251024-1746-B400_B.14-53/10/pdata/1/peaks!
52	07:46:48	20251024-1746-B400_B.14-52	12	F19_NoCPD_Night	b72547am	-	+	-	-	-	+	+	Ref 5-9R1 ovn 50C Group Larrosa_I	sref: reference peak outside file limits default calibration done, sref: reference peak outside file limits default calibration done
52	07:03:13	20251024-1746-B400_B.14-52	11	F19_Quant_D35_Night	b72547am	-	+	-	-	-	+	+	Ref 5-9R1 ovn 50C Group Larrosa_I	sref: reference peak outside file limits default calibration done, sref: reference peak outside file limits default calibration done
52	06:58:54	20251024-1746-B400_B.14-52	10	H1_Night	b72547am	+	+	-	+	+	+	+	Ref 5-9R1 ovn 50C Group Larrosa_I
51	06:25:46	20251024-1746-B400_B.14-51	13	H1_WaterSupp_Night	b72547am	-	+	-	-	-	+	+	Ref 5-8R2 ovn 50C Group Larrosa_I	autophase: Command 'autophase' only possible with locked sample! Current LOCK Status is OFF, pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Larrosa_I/data/b72547am/nmr/20251024-1746-B400_B.14-51/13/pdata/1/peaks!, pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Larrosa_I/data/b72547am/nmr/20251024-1746-B400_B.14-51/13/pdata/1/peaks!
51	06:18:15	20251024-1746-B400_B.14-51	12	F19_NoCPD_Night	b72547am	-	+	-	-	-	+	+	Ref 5-8R2 ovn 50C Group Larrosa_I
51	05:34:29	20251024-1746-B400_B.14-51	11	F19_Quant_D35_Night	b72547am	-	+	-	-	-	+	+	Ref 5-8R2 ovn 50C Group Larrosa_I
51	05:30:47	20251024-1746-B400_B.14-51	10	H1_Night	b72547am	+	+	-	+	-	+	+	Ref 5-8R2 ovn 50C Group Larrosa_I	pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Larrosa_I/data/b72547am/nmr/20251024-1746-B400_B.14-51/10/pdata/1/peaks!, pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Larrosa_I/data/b72547am/nmr/20251024-1746-B400_B.14-51/10/pdata/1/peaks!
50	05:24:01	20251024-1746-B400_B.14-50	12	F19_NoCPD_Night	b72547am	-	+	-	-	-	+	+	Ref 5-8R1 ovn 50C Group Larrosa_I	sref: reference peak outside file limits default calibration done, sref: reference peak outside file limits default calibration done
50	04:39:56	20251024-1746-B400_B.14-50	11	F19_Quant_D35_Night	b72547am	-	+	-	-	-	+	+	Ref 5-8R1 ovn 50C Group Larrosa_I	sref: reference peak outside file limits default calibration done, sref: reference peak outside file limits default calibration done
50	04:35:17	20251024-1746-B400_B.14-50	10	H1_Night	b72547am	+	+	-	+	+	+	+	Ref 5-8R1 ovn 50C Group Larrosa_I
3	04:06:40	20251024-1600-B400_B.14-3	10	P31_CPD_Night	m61564jh	+	+	-	+	+	+	+	Ref EX_4_P2 A_JQ Group Keerthi_A	sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0
57	03:50:08	20251024-1546-B400_B.14-57	10	C13_CPD_Night256	u67812sg	+	+	-	+	+	+	+	Ref selina-L21B Group Procter_D	sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
56	03:32:57	20251024-1544-B400_B.14-56	10	C13_CPD_Night256	u67812sg	+	+	-	+	+	+	+	Ref selinaP(OH)3 Group Procter_D	sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
16	03:09:05	20251024-1458-B400_B.14-16	10	H1_Quant_d1_56s_Night	r60833in	+	+	-	+	+	+	+	Ref F Group Cobb_S
15	02:45:13	20251024-1458-B400_B.14-15	10	H1_Quant_d1_56s_Night	r60833in	+	+	-	+	+	+	+	Ref E Group Cobb_S
14	02:21:33	20251024-1458-B400_B.14-14	10	H1_Quant_d1_56s_Night	r60833in	+	+	-	+	+	+	+	Ref D Group Cobb_S
13	01:57:47	20251024-1458-B400_B.14-13	10	H1_Quant_d1_56s_Night	r60833in	+	+	-	+	+	+	+	Ref C Group Cobb_S
12	01:34:06	20251024-1458-B400_B.14-12	10	H1_Quant_d1_56s_Night	r60833in	+	+	-	+	+	+	+	Ref B Group Cobb_S
11	01:09:37	20251024-1457-B400_B.14-11	10	H1_Quant_d1_56s_Night	r60833in	+	+	-	+	+	+	+	Ref A Group Cobb_S
7	00:45:04	20251023-1758-B400_B.14-7	10	H1_Quant_d1_56s_Night	m56482jm	+	+	-	+	+	+	+	Ref JAM022 Group Cobb_S
6	00:15:50	20251023-1757-B400_B.14-6	10	H1_Quant_d1_56s_Night	m56482jm	+	+	-	+	x	+	+	Ref JAM021 Group Cobb_S	topshim: TopshimWaitForEvent - acquisition completed : timeout after 320 sec, Shim failed
33	23:51:49	20251023-1642-B400_B.14-33	10	H1_Quant_d1_56s_Night	p98722sl	+	+	-	+	+	+	+	Ref SC-AT-08 Group Cobb_S
32	23:28:10	20251023-1642-B400_B.14-32	10	H1_Quant_d1_56s_Night	p98722sl	+	+	-	+	+	+	+	Ref SC-AT-07 Group Cobb_S
31	23:04:01	20251023-1641-B400_B.14-31	10	H1_Quant_d1_56s_Night	p98722sl	+	+	-	+	+	+	+	Ref SC-AT-06 Group Cobb_S
30	22:45:38	20251023-1632-B400_B.14-30	14	H1_C13_HMBC_US_Night	mbdxrbj2	-	+	-	-	-	+	+	Ref BJ568_FC Group Procter_D
30	22:19:42	20251023-1632-B400_B.14-30	13	H1_C13_HSQCed_Night	mbdxrbj2	+	+	-	+	+	+	+	Ref BJ568_FC Group Procter_D
29	21:55:15	20251023-1015-B400_B.14-29	10	H1_Quant_d1_56s_Night	m56482jm	+	+	-	+	+	+	+	Ref JAM014 Group Cobb_S
28	21:30:38	20251023-1015-B400_B.14-28	10	H1_Quant_d1_56s_Night	m56482jm	+	+	-	+	+	+	+	Ref JAM013 Group Cobb_S
27	21:05:40	20251023-1014-B400_B.14-27	10	H1_Quant_d1_56s_Night	m56482jm	+	+	-	+	+	+	+	Ref JAM012 Group Cobb_S
26	20:40:46	20251023-1013-B400_B.14-26	10	H1_Quant_d1_56s_Night	m56482jm	+	+	-	+	+	+	+	Ref JAM011 Group Cobb_S
25	20:16:50	20251023-1012-B400_B.14-25	10	H1_Quant_d1_56s_Night	m56482jm	+	+	-	+	+	+	+	Ref JAM004 Group Cobb_S
24	19:52:56	20251023-1011-B400_B.14-24	10	H1_Quant_d1_56s_Night	m56482jm	+	+	-	+	+	+	+	Ref JAM003 Group Cobb_S
23	19:28:59	20251023-1009-B400_B.14-23	10	H1_Quant_d1_56s_Night	m56482jm	+	+	-	+	+	+	+	Ref JAM002 Group Cobb_S
22	19:04:10	20251023-1007-B400_B.14-22	10	H1_Quant_d1_56s_Night	m56482jm	+	+	-	+	+	+	+	Ref JAM001 Group Cobb_S
48	18:46:54	20251024-1501-B400_B.14-48	11	C13_CPD_Night256	u67812sg	+	+	-	+	+	+	+	Ref 29art2 cycloA Group Procter_D	sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
47	18:30:09	20251024-1459-B400_B.14-47	11	C13_CPD_Night256	u67812sg	+	+	-	+	+	+	+	Ref 29 part1B Group Procter_D	sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
46	18:12:24	20251024-1452-B400_B.14-46	10	C13_CPD_Night256	u67812sg	+	+	-	+	+	+	+	Ref E4 Group Procter_D	sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
43	18:03:50	20251024-1412-B400_B.14-43	10	H1_Quant_Night	j03696rc	+	+	-	+	+	+	+	Ref RCCS003 Group Shaver_M
42	17:55:15	20251024-1412-B400_B.14-42	10	H1_Quant_Night	j03696rc	+	+	-	+	+	+	+	Ref RCCS002 Group Shaver_M
41	17:46:36	20251024-1412-B400_B.14-41	10	H1_Quant_Night	j03696rc	+	+	-	+	+	+	+	Ref RCCS001 Group Shaver_M
39	17:38:12	20251024-1236-B400_B.14-39	10	H1_Quant_Night	w12998gm	+	+	-	+	+	+	+	Ref il-gm-9-053-d-crude Group Larrosa_I
38	17:29:48	20251024-1236-B400_B.14-38	10	H1_Quant_Night	w12998gm	+	+	-	+	+	+	+	Ref il-gm-9-053-c-crude Group Larrosa_I
37	17:21:38	20251024-1236-B400_B.14-37	10	H1_Quant_Night	w12998gm	+	+	-	+	+	+	+	Ref il-gm-9-053-b-crude Group Larrosa_I
36	17:13:13	20251024-1236-B400_B.14-36	10	H1_Quant_Night	w12998gm	+	+	-	+	+	+	+	Ref il-gm-9-053-a-crude Group Larrosa_I
35	17:08:40	20251024-1236-B400_B.14-35	10	H1_Night	w12998gm	+	+	-	+	+	+	+	Ref il-gm-9-052-crude Group Larrosa_I
34	17:04:06	20251024-1236-B400_B.14-34	10	H1_Night	w12998gm	+	+	-	+	+	+	+	Ref il-gm-9-051-crude Group Larrosa_I
40	16:59:12	20251024-1653-B400_B.14-40	10	H1_Day	b26045ab	+	+	-	+	+	+	+	Ref AT-ABO-02-497P-543S Group Trowbridge_A
21	16:53:39	20251024-1644-B400_B.14-21	10	H1_Day	n29715ss	+	+	-	+	+	+	+	Ref DJP-SS-18repeat Group Procter_D
20	16:38:12	20251024-1155-B400_B.14-20	13	H1_C13_HSQC_US_Night	j40457bh	+	+	-	+	+	+	+	Ref bh ah 131 c1 Group Trowbridge_A
8	16:33:37	20251024-1628-B400_B.14-8	10	H1_Day	w52164bc	+	+	-	+	+	+	+	Ref BC-11-142 P1 Group James_M
5	16:28:59	20251024-1618-B400_B.14-5	10	H1_Day	z40973rs	+	+	-	+	+	+	+	Ref gdb-rs-143 conversion Group DeBo_G
4	16:26:58	20251024-1617-B400_B.14-4	11	F19_NoCPD_Day	s52134ad	-	+	-	-	-	+	+	Ref AJD J42 (c) Group Larrosa_I	sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0
4	16:21:56	20251024-1617-B400_B.14-4	10	H1_Day	s52134ad	+	+	-	+	+	+	+	Ref AJD J42 (c) Group Larrosa_I
2	16:17:28	20251024-1600-B400_B.14-2	10	P31_CPD_Day	m61564jh	+	+	-	+	+	+	+	Ref EX_4_P1 B_JQ Group Keerthi_A	sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0
1	16:12:55	20251024-1558-B400_B.14-1	10	P31_CPD_Day	m61564jh	+	+	-	+	+	+	+	Ref XK_EX4_P2isoA Group Keerthi_A	sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0
59	16:08:32	20251024-1602-B400_B.14-59	10	H1_Day	mbdxkrn2	+	+	-	+	+	+	+	Ref GDB-RN1583 Column Main Band - Acetone-d6 Group DeBo_G
58	16:06:21	20251024-1548-B400_B.14-58	11	H1_Day	q62112nk	-	+	-	-	-	+	+	Ref djp-nk-1-2220-BS-3-Cr Group Procter_D
58	16:01:57	20251024-1548-B400_B.14-58	10	H1_Quant_NS1_Day	q62112nk	+	+	-	+	+	+	+	Ref djp-nk-1-2220-BS-3-Cr Group Procter_D
57	15:57:33	20251024-1546-B400_B.14-57	11	P31_CPD_Day	u67812sg	+	+	-	+	+	+	+	Ref selina-L21B Group Procter_D	sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0
56	15:53:14	20251024-1544-B400_B.14-56	11	P31_NoCPD_Day	u67812sg	+	+	-	+	+	+	+	Ref selinaP(OH)3 Group Procter_D	sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0
55	15:48:37	20251024-1517-B400_B.14-55	10	H1_Day	j31752jy	+	+	-	+	+	+	+	Ref TP-T2 Group Gibson_M
54	15:44:08	20251024-1517-B400_B.14-54	10	H1_Day	j31752jy	+	+	-	+	+	+	+	Ref TP-t0 Group Gibson_M
53	15:37:48	20251024-1513-B400_B.14-53	12	F19_CPD_Day	f25045cc	-	+	-	-	-	+	+	Ref CJC-DW-3-rerun/moredrying Group Willcox_D	sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0
53	15:34:25	20251024-1513-B400_B.14-53	11	B11_CPD_Day	f25045cc	-	+	-	-	-	+	+	Ref CJC-DW-3-rerun/moredrying Group Willcox_D	sref: NUCLEUS '11B' not defined for SOLVENT 'CDCl3' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Willcox_D/data/f25045cc/nmr/20251024-1513-B400_B.14-53/11/pdata/1/peaks!, sref: NUCLEUS '11B' not defined for SOLVENT 'CDCl3' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Willcox_D/data/f25045cc/nmr/20251024-1513-B400_B.14-53/11/pdata/1/peaks!
53	15:29:34	20251024-1513-B400_B.14-53	10	H1_Day	f25045cc	+	+	-	+	+	+	+	Ref CJC-DW-3-rerun/moredrying Group Willcox_D
52	15:25:04	20251024-1508-B400_B.14-52	10	H1_Day	r25963ar	+	+	-	+	+	+	+	Ref fraction 3 Group Romanov_A fraction 3
51	15:20:31	20251024-1507-B400_B.14-51	10	H1_Day	r25963ar	+	+	-	+	+	+	+	Ref fraction 2 Group Romanov_A fraction 2
50	15:15:57	20251024-1506-B400_B.14-50	10	H1_Day	r25963ar	+	+	-	+	+	+	+	Ref fraction 1 Group Romanov_A fraction 1
48	15:11:07	20251024-1501-B400_B.14-48	10	P31_CPD_Day	u67812sg	+	+	-	+	+	+	+	Ref 29art2 cycloA Group Procter_D	sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0
47	15:06:41	20251024-1459-B400_B.14-47	10	P31_CPD_Day	u67812sg	+	+	-	+	+	+	+	Ref 29 part1B Group Procter_D	sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0
46	15:01:28	20251024-1452-B400_B.14-46	11	P31_CPD_Day	u67812sg	+	+	-	+	+	+	+	Ref E 4 Group Procter_D	sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '31P' not defined for SOLVENT 'CDCl3' SR is set to 0.0
45	14:56:31	20251024-1447-B400_B.14-45	10	H1_Day	g16660ml	+	+	-	+	+	+	+	Ref djp-muze Group Procter_D
44	14:51:18	20251024-1445-B400_B.14-44	10	H1_Day	e02956op	+	+	-	+	+	+	+	Ref GDB_OP0361-RmX_16h_60C-1H_CDCl3 Group DeBo_G
40	14:46:35	20251024-1437-B400_B.14-40	10	H1_Day	b26045ab	+	+	-	+	+	+	+	Ref AT-ABO-02-539-iso Group Trowbridge_A
21	14:42:31	20251024-1437-B400_B.14-21	10	H1_Day	b26045ab	+	+	-	+	+	+	+	Ref AT-ABO-02-538-iso Group Trowbridge_A
20	14:35:15	20251024-1155-B400_B.14-20	12	F19_CPD_Night	j40457bh	-	+	-	-	-	+	+	Ref bh ah 131 c1 Group Trowbridge_A	sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0
20	14:20:49	20251024-1155-B400_B.14-20	11	C13_CPD_Night256	j40457bh	-	+	-	-	-	+	+	Ref bh ah 131 c1 Group Trowbridge_A	sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
20	14:15:59	20251024-1155-B400_B.14-20	10	H1_Night	j40457bh	+	+	-	+	+	+	+	Ref bh ah 131 c1 Group Trowbridge_A
19	14:01:10	20251024-1154-B400_B.14-19	13	H1_C13_HSQC_US_Night	j40457bh	+	+	-	+	+	+	+	Ref bhah130 c1 Group Trowbridge_A
41	13:57:14	20251024-1347-B400_B.14-41	10	H1_Day	y38246dt	+	+	-	+	+	+	+	Ref GDB-DT-610-Check Group DeBo_G GDB-DT-610-Check
40	13:52:31	20251024-1345-B400_B.14-40	10	H1_Day	g16660ml	+	+	-	+	+	+	+	Ref djp-muze-2 Group Procter_D
21	13:47:57	20251024-1344-B400_B.14-21	10	H1_Day	g16660ml	+	+	-	+	+	+	+	Ref djp-muze-1 Group Procter_D
19	13:40:02	20251024-1154-B400_B.14-19	12	F19_CPD_Night	j40457bh	-	+	-	-	-	+	+	Ref bhah130 c1 Group Trowbridge_A	sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0
19	13:24:45	20251024-1154-B400_B.14-19	11	C13_CPD_Night256	j40457bh	-	+	-	-	-	+	+	Ref bhah130 c1 Group Trowbridge_A	sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
19	13:20:20	20251024-1154-B400_B.14-19	10	H1_Night	j40457bh	+	+	-	+	+	+	+	Ref bhah130 c1 Group Trowbridge_A
9	13:15:59	20251024-1312-B400_B.14-9	10	H1_Day	s21540as	+	+	-	+	+	+	+	Ref AS-01-009-F33-43 Group Other
59	13:11:13	20251024-1307-B400_B.14-59	10	H1_Day	b32507dt	+	+	-	+	+	+	+	Ref dtgb133 Group Webb_S
58	13:06:55	20251024-1251-B400_B.14-58	10	H1_Day	h91839em	+	+	-	+	+	+	+	Ref gc em 148 C Group Crisenza_G
57	13:01:31	20251024-1203-B400_B.14-57	10	F19_Quant_D1_8s_Day	b72547am	+	+	-	+	-	+	+	Ref 5-14 R4 ovn 55C Group Larrosa_I
56	12:56:32	20251024-1251-B400_B.14-56	10	H1_Day	h91839em	+	+	-	+	+	+	+	Ref gc em 147 c Group Crisenza_G
55	12:52:09	20251024-1250-B400_B.14-55	10	H1_Day	h91839em	+	+	-	+	+	+	+	Ref gc em 146 c Group Crisenza_G
54	12:46:12	20251024-1202-B400_B.14-54	11	F19_Quant_D1_8s_Day	b72547am	-	+	-	-	-	+	+	Ref 5-15 Group Larrosa_I
54	12:42:58	20251024-1202-B400_B.14-54	10	H1_Day	b72547am	+	+	-	+	-	+	+	Ref 5-15 Group Larrosa_I	pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Larrosa_I/data/b72547am/nmr/20251024-1202-B400_B.14-54/10/pdata/1/peaks!, pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Larrosa_I/data/b72547am/nmr/20251024-1202-B400_B.14-54/10/pdata/1/peaks!
52	12:38:51	20251024-1211-B400_B.14-52	10	H1_Day	a15978el	+	+	-	+	+	+	+	Ref EL-04-055 f27-58 Group James_M
51	12:36:31	20251024-1205-B400_B.14-51	11	P31_Wide_Day	k33462nk	-	+	-	-	-	+	+	Ref nk 1-4 p1 hv Group Trowbridge_A	sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
51	12:32:25	20251024-1205-B400_B.14-51	10	H1_Day	k33462nk	+	+	-	+	x	+	+	Ref nk 1-4 p1 hv Group Trowbridge_A	topshim: TopshimFieldMap - no valid data in sample centre, Shim failed
50	12:26:48	20251024-1200-B400_B.14-50	11	F19_Quant_D1_8s_Day	b72547am	+	+	-	+	-	+	+	Ref 5-14 R3 ovn 50C Group Larrosa_I
49	12:20:54	20251024-1200-B400_B.14-49	11	F19_Quant_D1_8s_Day	b72547am	+	+	-	+	-	+	+	Ref 5-14 R2 ovn 50C Group Larrosa_I
48	12:15:07	20251024-1200-B400_B.14-48	11	F19_Quant_D1_8s_Day	b72547am	-	+	-	-	-	+	+	Ref 5-14 R1 ovn 50C Group Larrosa_I	sref: reference peak outside file limits default calibration done, sref: reference peak outside file limits default calibration done
48	12:09:43	20251024-1200-B400_B.14-48	10	H1_Day	b72547am	+	+	-	+	+	+	+	Ref 5-14 R1 ovn 50C Group Larrosa_I
47	12:04:46	20251024-1152-B400_B.14-47	10	H1_Day	j40457bh	+	+	-	+	+	+	+	Ref bh ah 135 Group Trowbridge_A
46	11:59:50	20251024-1152-B400_B.14-46	10	H1_Day	j40457bh	+	+	-	+	+	+	+	Ref bh ah 134 Group Trowbridge_A
45	11:55:06	20251024-1152-B400_B.14-45	10	H1_Day	j40457bh	+	+	-	+	+	+	+	Ref bh ah 133 Group Trowbridge_A
44	11:53:14	20251024-1136-B400_B.14-44	11	F19_NoCPD_Day	s52134ad	-	+	-	-	-	+	+	Ref AJD J40 (f 10-19) Group Larrosa_I	sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0
44	11:48:27	20251024-1136-B400_B.14-44	10	H1_Day	s52134ad	+	+	-	+	+	+	+	Ref AJD J40 (f 10-19) Group Larrosa_I
43	11:44:17	20251024-1133-B400_B.14-43	10	H1_Day	g23544jd	+	+	-	+	+	+	+	Ref MJJ-JDL-5B-034-2-P Group James_M
42	11:39:58	20251024-1133-B400_B.14-42	10	H1_Day	g23544jd	+	+	-	+	+	+	+	Ref MJJ-JDL-05-068-P2 Group James_M
41	11:35:31	20251024-1133-B400_B.14-41	10	H1_Day	g23544jd	+	+	-	+	+	+	+	Ref MJJ-JDL-05-068-P1 Group James_M
35	11:23:18	20251024-1115-B400_B.14-35	10	H1_Day	w52164bc	+	+	-	+	+	+	+	Ref BC-11-142 Group James_M
34	11:20:06	20251024-1114-B400_B.14-34	11	F19_CPD_Day	w52164bc	-	+	-	-	-	+	+	Ref BC-11-140 P2 Group James_M	sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0
34	11:15:01	20251024-1114-B400_B.14-34	10	H1_Day	w52164bc	+	+	-	+	+	+	+	Ref BC-11-140 P2 Group James_M
15	10:44:02	20251024-1039-B400_B.14-15	11	F19_Quant_D1_8s_Day	u50028ip	-	+	-	-	-	+	+	Ref Ura antracene salt Group Larrosa_I	sref: NUCLEUS '19F' not defined for SOLVENT 'DMSO' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'DMSO' SR is set to 0.0
15	10:39:53	20251024-1039-B400_B.14-15	10	H1_Day	u50028ip	+	+	-	+	+	+	+	Ref Ura antracene salt Group Larrosa_I
1	10:30:09	20251024-1027-B400_B.14-1	10	H1_Day	n67799bm	+	+	-	+	+	+	+	Ref ni8fc6_12hr_photo Group Schroder_M
39	10:20:55	20251024-0941-B400_B.14-39	10	H1_Day	s21540as	+	+	-	+	+	+	+	Ref AS-01-011-RM Group Other
38	10:14:59	20251024-0931-B400_B.14-38	10	H1_Day	x73847lm	+	+	-	+	+	+	+	Ref IR-LJM-01-119.2 Group Riddell_I
9	18:31:47	20251023-1536-B400_B.14-9	10	H1_Night	b26045ab	x	-	-	-	-	-	-	Ref AT-ABO-02-533-P1 Group Trowbridge_A	WebService Error: Changer has been busy for the past 5 minutes. Cannot transfer the sample.
37	18:26:45	20251023-1812-B400_B.14-37	10	H1_Day	s52134ad	x	-	-	-	-	-	-	Ref AJD J40 (f 10-19) Group Larrosa_I	WebService Error: Changer has been busy for the past 5 minutes. Cannot transfer the sample.
36	18:26:31	20251023-1821-B400_B.14-36	10	H1_Day	b26045ab	-	-	-	-	-	-	-	Ref AT-ABO-02-536-P1 Group Trowbridge_A
35	18:09:43	20251023-1656-B400_B.14-35	11	C13_CPD_Night256	z40241jm	+	+	-	+	+	+	+	Ref DJP-JIM-7-122-1b-crude Group Procter_D
30	17:55:44	20251023-1632-B400_B.14-30	12	H1_COSY_HiRes_Night	mbdxrbj2	+	+	-	+	+	+	+	Ref BJ568_FC Group Procter_D
36	17:50:05	20251023-1736-B400_B.14-36	10	H1_Day	j40457bh	+	+	-	+	+	+	+	Ref bhah131 c1 Group Trowbridge_A
34	17:45:31	20251023-1726-B400_B.14-34	10	H1_Day	j40457bh	+	+	-	+	+	+	+	Ref bhah130c1 Group Trowbridge_A
30	17:23:58	20251023-1632-B400_B.14-30	11	C13_CPD_Night256	mbdxrbj2	+	+	-	+	x	+	+	Ref BJ568_FC Group Procter_D	topshim: TopshimWaitForEvent - acquisition completed : timeout after 320 sec, Shim failed
34	17:19:23	20251023-1717-B400_B.14-34	10	H1_Day	e72206ov	+	+	-	+	+	+	+	Ref ov-A-008-b pure? Group DeBo_G
30	17:15:16	20251023-1632-B400_B.14-30	10	H1_Night	mbdxrbj2	+	+	-	+	+	+	+	Ref BJ568_FC Group Procter_D
35	17:10:43	20251023-1656-B400_B.14-35	10	H1_Day	z40241jm	+	+	-	+	+	+	+	Ref DJP-JIM-7-122-1b-crude Group Procter_D
34	17:06:19	20251023-1645-B400_B.14-34	10	H1_Day	h27839ea	+	+	-	+	+	+	+	Ref Isomer 3 Group Gardiner_J
21	17:01:51	20251023-1632-B400_B.14-21	10	H1_Day	mbdxrbj2	+	+	-	+	+	+	+	Ref BJ665_11-15 Group Procter_D
20	16:57:35	20251023-1632-B400_B.14-20	10	H1_Day	mbdxrbj2	+	+	-	+	+	+	+	Ref BJ664_14-25 Group Procter_D
19	16:52:39	20251023-1630-B400_B.14-19	10	H1_Day	z86427mk	+	+	-	+	+	+	+	Ref MK-247-B Group Procter_D
18	16:46:44	20251023-1630-B400_B.14-18	10	H1_Day	z86427mk	+	+	-	+	+	+	+	Ref MK-250 Group Procter_D
17	16:42:10	20251023-1546-B400_B.14-17	10	H1_Day	u50028ip	+	+	-	+	+	+	+	Ref NHBOC amide coupling quinoloine Group Larrosa_I
16	16:36:44	20251023-1546-B400_B.14-16	11	F19_Quant_D1_8s_Day	u50028ip	-	+	-	-	-	+	+	Ref antracene salt Group Larrosa_I	sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0
16	16:32:24	20251023-1546-B400_B.14-16	10	H1_Day	u50028ip	+	+	-	+	+	+	+	Ref antracene salt Group Larrosa_I
15	16:28:18	20251023-1540-B400_B.14-15	10	H1_Day	x73847lm	+	+	-	+	+	+	+	Ref IR_LJM-01-104 washed Group Riddell_I
14	16:24:02	20251023-1539-B400_B.14-14	10	H1_Day	x73847lm	+	+	-	+	+	+	+	Ref IR-LJM-NaTFB with TMS Group Riddell_I
13	16:19:09	20251023-1546-B400_B.14-13	10	H1_Day	u50028ip	+	+	-	+	+	+	+	Ref imine alkylation tubos 2-3 Group Larrosa_I
12	16:14:40	20251023-1538-B400_B.14-12	10	H1_Day	x73847lm	+	+	-	+	+	+	+	Ref IR-LJM-01-120E Group Riddell_I
11	16:10:13	20251023-1538-B400_B.14-11	10	H1_Day	x73847lm	+	+	-	+	+	+	+	Ref IR-LJM-01-120D Group Riddell_I
10	16:05:18	20251023-1537-B400_B.14-10	10	H1_Day	x73847lm	+	+	-	+	+	+	+	Ref IR-LJM -01-120C with TMS Group Riddell_I
8	16:00:34	20251023-1536-B400_B.14-8	10	H1_Day	b26045ab	+	+	-	+	+	+	+	Ref AT-ABO-02-537-cr Group Trowbridge_A
7	15:50:18	20251023-1519-B400_B.14-7	11	F19_Quant_D1_8s_Day	u50028ip	-	+	-	-	-	+	+	Ref NP-1885.1 Group Larrosa_I	sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0, sref: NUCLEUS '19F' not defined for SOLVENT 'CDCl3' SR is set to 0.0
7	15:45:33	20251023-1519-B400_B.14-7	10	H1_Day	u50028ip	+	+	-	+	+	+	+	Ref NP-1885.1 Group Larrosa_I
6	15:40:37	20251023-1518-B400_B.14-6	10	H1_Day	u50028ip	+	+	-	+	+	+	+	Ref Imine alquilation tubo 20 Group Larrosa_I
5	15:35:41	20251023-1519-B400_B.14-5	10	H1_Day	u50028ip	+	+	-	+	+	+	+	Ref imine alquilation tubo 5 Group Larrosa_I
4	15:31:06	20251023-1516-B400_B.14-4	10	H1_Quant_NS1_Day	y83900an	+	+	-	+	+	+	+	Ref IL-AMN-05-053-CRM Group Larrosa_I
3	15:26:54	20251023-1516-B400_B.14-3	10	H1_Quant_NS1_Day	y83900an	+	+	-	+	+	+	+	Ref IL-AMN-05-051-CRM Group Larrosa_I
2	15:22:14	20251023-1514-B400_B.14-2	10	H1_Quant_NS1_Day	y83900an	+	+	-	+	+	+	+	Ref IL-AMN-05-050-CRM Group Larrosa_I
1	15:17:49	20251023-1513-B400_B.14-1	10	H1_Quant_NS1_Day	y83900an	+	+	-	+	+	+	+	Ref IL-AMN-05-049-CRM Group Larrosa_I
50	14:54:58	20251023-1454-B400_B.14-50	10	H1_Day	z40241jm	+	+	-	+	+	+	+	Ref DJP-JIM-7-125-2a-spot1 Group Procter_D
35	14:35:03	20251023-1426-B400_B.14-35	10	H1_Day	j40457bh	+	+	-	+	+	+	+	Ref bhah131 Group Trowbridge_A
34	14:30:15	20251023-1426-B400_B.14-34	10	H1_Day	j40457bh	+	+	-	+	+	+	+	Ref bhah130 Group Trowbridge_A
33	14:24:02	20251023-1411-B400_B.14-34	10	F19_NoCPD_Day	q62112nk	+	+	-	+	+	+	+	Ref djp-rb-540 Group Procter_D	xauw: Compiling AU program 'proc_1dapks' Please wait, Compilation finished; sref: NUCLEUS '19F' not defined for SOLVENT 'DMSO' SR is set to 0.0, xauw: Compiling AU program 'proc_1dapks' Please wait, Compilation finished; sref: NUCLEUS '19F' not defined for SOLVENT 'DMSO' SR is set to 0.0
32	14:20:02	20251023-1411-B400_B.14-32	10	H1_Quant_NS1_Day	q62112nk	+	+	-	+	+	+	+	Ref djp-nk-1-241purity Group Procter_D
31	14:15:29	20251023-1410-B400_B.14-31	10	H1_Day	p98090lm	+	+	-	+	+	+	+	Ref MLT-LSM-14 hex-1,3-diene Group Turner_M
30	14:11:09	20251023-1409-B400_B.14-30	10	H1_Day	p98090lm	+	+	-	+	+	+	+	Ref MLT-LSM-13 hex-2,4-diene Group Turner_M
35	14:00:36	20251023-1355-B400_B.14-35	10	H1_Day	mbdxrbj2	+	+	-	+	+	+	+	Ref BJ659_12-22 Group Procter_D
34	13:56:29	20251023-1355-B400_B.14-34	10	H1_Day	mbdxrbj2	+	+	-	+	+	+	+	Ref BJ659_9-11 Group Procter_D
32	13:33:42	20251023-1331-B400_B.14-32	10	P31_Wide_Day	k33462nk	+	+	-	+	+	+	+	Ref nk 1-4 P Group Trowbridge_A	sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
33	13:25:27	20251023-1325-B400_B.14-33	10	H1_Day	x73847lm	+	+	-	+	+	+	+	Ref IR-LJM-01-124 C F16 Group Riddell_I
31	13:12:12	20251023-1311-B400_B.14-31	10	H1_Day	b26045ab	+	+	-	+	+	+	+	Ref AT-ABO-02-533-F15-16 Group Trowbridge_A
30	13:01:07	20251023-1300-B400_B.14-30	10	Al27_Day	j20588jh	+	+	-	+	+	+	+	Ref JH-DW-39.03.1-DippZnAlCl Et3P=S Group Willcox_D +24hrs @ 75	sref: NUCLEUS '27Al' not defined for SOLVENT 'C6D6' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Willcox_D/data/j20588jh/nmr/20251023-1300-B400_B.14-30/10/pdata/1/peaks!, sref: NUCLEUS '27Al' not defined for SOLVENT 'C6D6' SR is set to 0.0; pp: Cannot find the scaling regions file! It cannot be used for peak assignment for scaling of /mnt/nmrdata/Willcox_D/data/j20588jh/nmr/20251023-1300-B400_B.14-30/10/pdata/1/peaks!
44	10:49:13	20251023-1021-B400_B.14-44	11	C13_CPD_Night256	e02956op	+	+	-	+	+	+	+	Ref GDB_OP0360_A-13C_CDCl3 Group DeBo_G	sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
46	10:44:46	20251023-1028-B400_B.14-46	10	H1_Day	b59259yj	+	+	-	+	+	+	+	Ref MTYJA72hBath5 Group Turner_M
45	10:40:20	20251023-1018-B400_B.14-45	10	H1_Day	a15978el	+	+	-	+	+	+	+	Ref EL-04-059-c Group James_M
44	10:36:00	20251023-1021-B400_B.14-44	10	H1_Day	e02956op	+	+	-	+	+	+	+	Ref GDB_OP0360_A-1H_CDCl3 Group DeBo_G
43	10:31:22	20251023-1018-B400_B.14-43	10	H1_Day	a15978el	+	+	-	+	+	+	+	Ref EL-04-058-c Group James_M
42	10:26:47	20251023-1017-B400_B.14-42	10	H1_Day	a15978el	+	+	-	+	+	+	+	Ref EL-04-057-c Group James_M
41	10:17:58	20251023-1017-B400_B.14-41	10	H1_Day	a15978el	+	+	-	+	x	+	+	Ref EL-04-052-e Group James_M	topshim: TopshimWaitForEvent - acquisition completed : timeout after 320 sec, Shim failed
39	09:41:38	20251023-0941-B400_B.14-39	10	H1_Day	b26045ab	+	+	-	+	+	+	+	Ref AT-ABO-02-533-hydro-Boc-cr Group Trowbridge_A
38	09:18:23	20251023-0913-B400_B.14-38	10	H1_Day	mbdxkrn2	+	+	-	+	+	+	+	Ref GDB-RN1580 Crude - Acetone-d6 Group DeBo_G
37	09:14:03	20251023-0913-B400_B.14-37	10	H1_Day	mbdxkrn2	+	+	-	+	+	+	+	Ref GDB-RN1579(ii) Crude - Acetone-d6 Group DeBo_G
21	08:56:30	20251023-0855-B400_B.14-21	10	H1_WaterSupp_Day	s21540as	+	+	-	+	+	+	+	Ref AS-01-009-RM Group Other
20	08:26:08	20251023-0825-B400_B.14-20	10	H1_Day	g23544jd	+	+	-	+	+	+	+	Ref MJJ-JDL-05-070 Group James_M
16	08:14:16	20251023-0813-B400_B.14-16	10	H1_Day	mbdxkrn2	+	+	-	+	+	+	+	Ref GDB-RN1580 Mixture after 20h - Acetone-d6 Group DeBo_G
9	07:57:40	20251023-0756-B400_B.14-9	10	H1_Day	e02956op	+	+	-	+	+	+	+	Ref GDB-OP0360_RmX_1H_CDCCl3 Group DeBo_G
60	22:26:09	20251022-2128-B400_B.14-60	10	H1_WaterSupp_Day	f56027ch	+	+	-	+	+	+	+	Ref Ag_Cu-2 4_5 -1.2v Group Schroder_M	sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
59	22:19:24	20251022-2128-B400_B.14-59	10	H1_WaterSupp_Day	f56027ch	+	+	-	+	+	+	+	Ref Ag_Cu-2 4_5 -1.1v Group Schroder_M	sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
58	22:11:58	20251022-2128-B400_B.14-58	10	H1_WaterSupp_Day	f56027ch	+	+	-	+	+	+	+	Ref Ag_Cu-2 4_5 -1.0v Group Schroder_M	findwaterTS3: Compiling AU program 'pulsecal' Please wait, Compilation finished; xauw: Compiling AU program 'saveprofpars' Please wait, Compilation finished, sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
15	21:53:32	20251022-2008-B400_B.14-15	14	H1_C13_HMBC_US_Night	y52364mw	-	+	-	-	-	+	+	Ref GDB-MJ-317-FULL-be washed by acetone Group DeBo_G
15	21:41:12	20251022-2008-B400_B.14-15	13	H1_C13_HSQC_US_Night	y52364mw	-	+	-	-	-	+	+	Ref GDB-MJ-317-FULL-be washed by acetone Group DeBo_G	xauw: Compiling AU program 'proc_2dpl' Please wait, Compilation finished, xauw: Compiling AU program 'proc_2dpl' Please wait, Compilation finished
15	21:29:17	20251022-2008-B400_B.14-15	12	H1_COSY_HiRes_Night	y52364mw	-	+	-	-	-	+	+	Ref GDB-MJ-317-FULL-be washed by acetone Group DeBo_G
15	20:35:16	20251022-2008-B400_B.14-15	11	C13_CPD_Night256	y52364mw	-	+	-	-	-	+	+	Ref GDB-MJ-317-FULL-be washed by acetone Group DeBo_G	sref: reference peak not found default calibration done, sref: reference peak not found default calibration done
15	20:31:13	20251022-2008-B400_B.14-15	10	H1_Night	y52364mw	+	+	-	+	+	+	+	Ref GDB-MJ-317-FULL-be washed by acetone Group DeBo_G
14	20:23:03	20251022-2006-B400_B.14-14	10	H1_COSY_Day	y52364mw	+	+	-	+	+	+	+	Ref GDB-MJ-55-DMSO Group DeBo_G
13	20:18:37	20251022-2006-B400_B.14-13	10	H1_Night	y52364mw	+	+	-	+	+	+	+	Ref GDB-MJ-157-P2 Group DeBo_G
12	20:14:09	20251022-2005-B400_B.14-12	10	H1_Night	y52364mw	+	+	-	+	+	+	+	Ref GDB-MJ-157-P1 Group DeBo_G
11	20:08:47	20251022-2005-B400_B.14-11	10	H1_Night	y52364mw	+	+	-	+	+	+	+	Ref GDB-MJ-157-P0 Group DeBo_G
7	18:44:59	20251022-1753-B400_B.14-7	11	C13_CPD_Night256	z40241jm	+	+	-	+	+	+	+	Ref DJP-JIM-7-CAS:5272-36-6-bottle Group Procter_D
6	18:27:49	20251022-1753-B400_B.14-6	11	C13_CPD_Night256	z40241jm	+	+	-	+	+	+	+	Ref DJP-JIM-7-CAS:1066-54-2-bottle Group Procter_D	xauw: Compiling AU program 'proc_1d' Please wait, Compilation finished, xauw: Compiling AU program 'proc_1d' Please wait, Compilation finished
10	18:18:44	20251022-1817-B400_B.14-10	10	H1_Day	z40241jm	+	+	-	+	x	+	+	Ref DJP-JIM-7-125-1a Group Procter_D	topshim: TopshimWaitForEvent - acquisition completed : timeout after 320 sec, Shim failed
8	18:14:20	20251022-1803-B400_B.14-8	10	H1_Day	b26045ab	+	+	-	+	+	+	+	Ref AT-ABO-02-534-iso Group Trowbridge_A
7	18:09:32	20251022-1753-B400_B.14-7	10	H1_Day	z40241jm	+	+	-	+	+	+	+	Ref DJP-JIM-7-CAS:5272-36-6-bottle Group Procter_D
6	18:04:58	20251022-1753-B400_B.14-6	10	H1_Day	z40241jm	+	+	-	+	+	+	+	Ref DJP-JIM-7-CAS:1066-54-2-bottle Group Procter_D
5	18:00:28	20251022-1750-B400_B.14-5	10	H1_Day	b26045ab	+	+	-	+	+	+	+	Ref AT-ABO-02-535-cr Group Trowbridge_A
4	17:55:01	20251022-1749-B400_B.14-4	10	H1_Day	e72206ov	+	+	-	+	+	+	+	Ref ov-A-008-a post2ndcol Group DeBo_G
3	17:50:35	20251022-1749-B400_B.14-3	10	H1_Day	e72206ov	+	+	-	+	+	+	+	Ref ov-A-007-b pure? Group DeBo_G
2	17:40:05	20251022-1735-B400_B.14-2	10	H1_Day	k97860rh	+	+	-	+	+	+	+	Ref RH04b Group Romanov_A
1	17:35:04	20251022-1733-B400_B.14-1	10	H1_Day	k97860rh	+	+	-	+	+	+	+	Ref RH04a Group Romanov_A	mproc_1dconlf: Compiling AU program 'plot_to_file' Please wait, Compilation finished, mproc_1dconlf: Compiling AU program 'plot_to_file' Please wait, Compilation finished