$^1H$ NNR Solvent Shifts

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Nov 3, 2020
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- $^{13}C$ solvent shifts
- Infrared Spectroscopy Absorption Table

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The following table lists Proton NMR Chemical Shifts of common laboratory solvents and impurities.

	proton	mult, J (Hz)	CDCl₃	CD₂Cl₂	THF-d₈	toluene-d₈	C₆D₆	C₆D₅Cl	(CD₃)₂CO	(CD₃)₂SO	CD₃CN	TFE-d₃	CD₃OD	D₂O
solvent residual signals	-	-	7.26	5.32	1.72	2.08	7.16	6.96	2.05	2.5	1.94	5.02	3.31	4.79
	-	-	-	-	3.58	6.97	-	6.99	-	-	-	3.88	-	-
	-	-	-	-	-	7.01	-	7.14	-	-	-	-	-	-
	-	-	-	-	-	7.09	-	-	-	-	-	-	-	-
water	OH	s	1.56	1.52	2.46	0.43	0.4	1.03	2.84	3.33	2.13	3.66	4.87	-
acetic acid	CH₃	s	2.10	2.06	1.89	1.57	1.52	1.76	1.96	1.91	1.96	2.06	1.99	2.08
acetone	CH₃	s	2.17	2.12	2.05	1.57	1.55	1.77	2.09	2.09	2.08	2.19	2.15	2.22
acetonitrile	CH₃	s	2.10	1.97	1.95	0.69	0.58	1.21	2.05	2.07	1.96	1.95	2.03	2.06
allyl acetate	CHCH₂	ddt	5.93	5.92	5.9	5.67	5.68	5.77	5.92	5.91	5.93	5.93	5.94	5.99
	CHCH₂(1)	ddt	5.32	5.31	5.27	5.05	5.06	5.15	5.29	5.29	5.29	5.32	5.30	5.37
	CHCH₂(2)	ddt	5.24	5.22	5.15	4.94	4.94	5.04	5.18	5.20	5.21	5.25	5.21	5.30
	CH₂	ddd	4.57	4.55	4.50	4.34	4.38	4.44	4.53	4.52	4.53	4.58	4.56	4.62
	CH₃	s	2.09	2.05	1.98	1.63	1.63	1.80	2.02	2.03	2.02	2.07	2.05	2.13
benzaldehyde	CHO	s	10.03	10.01	9.98	9.57	9.64	9.77	10.05	10.02	10.01	9.88	10	9.96
	CH(2,6)	m	7.88–7.91	7.87–7.89	7.86–7.88	7.45–7.47	7.49–7.53	7.59–7.61	7.92–7.94	7.91–7.93	7.89–7.91	7.90–7.92	7.90–7.93	7.97–7.99
	CH(3,5)	m	7.51–7.57	7.53–7.57	7.51–7.55	6.95–6.99	6.93–6.99	7.15–7.19	7.59–7.63	7.61–7.67	7.57–7.61	7.56–7.59	7.56–7.60	7.57–7.66
	CH(4)	m	7.61–7.65	7.63–7.67	7.60–7.64	7.03–7.07	7.01–7.07	7.24–7.28	7.69–7.73	7.69–7.75	7.67–7.71	7.68–7.72	7.66–7.70	7.76–7.80
benzene	CH	s	7.36	7.35	7.31	7.12	7.15	7.20	7.36	7.37	7.37	7.36	7.33	-
tert-butyl alcohol	CH₃	s	1.28	1.24	1.15	1.03	1.05	1.12	1.18	1.11	1.16	1.28	1.40	1.24
tert-butyl alcohol	OH	s	-	-	3.16	0.58	0.63	1.30	-	4.19	2.18	2.20	-	-
tert-butyl methyl ether	CCH₃	s	1.19	-	-	-	1.07	-	1.13	1.11	1.14	-	1.15	1.21
tert-butyl methyl ether	OCH₃	s	3.22	-	-	-	3.04	-	3.13	3.08	3.13	-	3.20	3.22
BHA	ArH	s	6.76	6.73	6.68	6.83	6.93	6.83	6.72	6.62	6.73	6.87	6.71	-
	OH	s	4.76	4.76	5.64	4.45	4.53	4.62	5.65	6.52	4.98	-	4.85	-
	ArOCH₃	s	3.77	3.73	3.68	3.48	3.48	3.61	3.72	3.66	3.72	3.79	3.72	-
	ArC(CH₃)₃	s	1.44	1.42	1.4	1.34	1.41	1.37	1.41	1.36	1.4	1.44	1.41	-
BHT	ArH	s	6.98	6.97	6.92	6.99	7.05	6.97	6.96	6.87	6.97	7.06	6.92	-
	OH	s	5.01	5.00	5.81	4.72	4.79	5.50	-	6.65	5.20	-	-	-
	ArCH₃	s	2.27	2.25	2.21	2.23	2.24	2.20	2.22	2.18	2.22	2.24	2.21	-
	ArC(CH₃)₃	s	1.43	1.42	1.4	1.36	1.38	1.37	1.41	1.36	1.39	1.43	1.40	-
chloroform	CH	s	7.26	7.32	7.89	6.10	6.15	6.74	8.02	8.32	7.58	7.33	7.90	-
18-crown-6	CH₂	s	3.67	3.59	3.57	3.36	3.39	3.41	3.59	3.51	3.51	3.64	3.64	3.80
cyclohexane	CH₂	s	1.43	1.44	1.44	1.40	1.40	1.37	1.43	1.40	1.44	1.47	1.45	-
cyclohexanone	CH₂(2,6)	t	2.33	2.29	2.24	1.95	1.98	2.08	2.27	2.25	2.27	2.38	2.34	2.40
	CH₂(3,5)	m	1.84–1.86	1.81–1.87	1.77–1.82	1.33–1.39	1.28–1.37	1.48–1.53	1.79–1.83	1.74–1.78	1.79–1.84	1.87–1.92	1.85–1.87	1.85–1.90
	CH₂(4)	m	1.71–1.73	1.69–1.72	1.68–1.71	1.16–1.20	1.08–1.16	1.33–1.37	1.70–1.74	1.64–1.66	1.67–1.72	1.75–1.78	1.74–1.76	1.70–1.75
diallyl carbonate	CHCH₂	ddt	5.94	5.95	5.92	5.63	5.65	5.75	5.96	5.93	5.96	5.92	5.94	5.99
	CHCH₂(1)	ddt	5.37	5.35	5.31	5.09	5.09	5.17	5.35	5.33	5.34	5.35	5.34	5.40
	CHCH₂(2)	ddt	5.27	5.26	5.19	4.92	4.92	5.03	5.23	5.25	5.25	5.28	5.25	5.32
	CH₂	ddd	4.64	4.61	4.58	4.34	4.38	4.46	4.62	4.61	4.61	4.62	4.61	4.69
1,2-dichloroethane	CH₂	s	3.73	3.76	3.77	2.91	2.90	3.26	3.87	3.90	3.81	3.71	3.78	-
dichloromethane	CH₂	s	5.30	5.33	5.51	4.32	4.27	4.77	5.63	5.76	5.44	5.24	5.49	-
diethyl ether	CH₃	t, 7	1.21	1.15	1.12	1.1	1.11	1.1	1.11	1.09	1.12	1.2	1.18	1.17
diethyl ether	CH₂	q, 7	3.48	3.43	3.38	3.25	3.26	3.31	3.41	3.38	3.42	3.58	3.49	3.56
diglyme	CH₂	m	3.65	3.57	3.43	3.43	3.46	3.49	3.56	3.51	3.53	3.67	3.61	3.67
	CH₂	m	3.57	3.50	3.53	3.31	3.34	3.37	3.47	3.38	3.45	3.62	3.58	3.61
	OCH₃	s	3.39	3.33	3.28	3.12	3.11	3.16	3.28	3.24	3.29	3.41	3.35	3.37
1,2-dimethoxyethane	CH₃	s	3.4	3.34	3.28	3.12	3.12	3.17	3.28	3.24	3.28	3.4	3.35	3.37
1,2-dimethoxyethane	CH₂	s	3.55	3.49	3.43	3.31	3.33	3.37	3.46	3.43	3.45	3.61	3.52	3.6
dimethylacetamide	CH₃CO	s	2.09	2.02	1.94	1.59	1.6	1.74	1.97	1.96	1.97	2.09	2.07	2.08
	NCH₃	s	3.02	2.97	2.95	2.56	2.57	2.65	3.00	2.94	2.96	3.05	3.31	3.06
	NCH₃	s	2.94	2.87	2.82	2.11	2.05	2.42	2.83	2.78	2.83	2.94	2.92	2.90
dimethyl carbonate	CH₃	s	3.79	3.75	3.69	3.31	3.30	3.48	3.72	3.69	3.72	3.77	3.74	3.69
dimethyl malonate	CH₃	s	3.75	3.72	3.65	3.24	3.23	3.41	3.68	3.65	3.68	3.76	3.72	3.78
dimethyl malonate	CH₂	s	3.4	3.37	3.35	2.92	2.97	3.15	3.42	3.53	3.38	3.41	3.44	3.60
dimethylformamide	CH	s	8.02	7.96	7.91	7.57	7.63	7.73	7.96	7.95	7.92	7.86	7.97	7.92
dimethylformamide	CH₃	s	2.88	2.82	2.76	1.96	1.86	2.30	2.78	2.73	2.77	2.88	2.86	2.85
dimethyl sulfoxide	CH₃	s	2.62	2.55	2.45	1.64	1.68	2.03	2.52	2.54	2.50	2.63	2.65	2.71
1,4-dioxane	CH₂	s	3.71	3.65	3.56	3.33	3.35	3.45	3.59	3.57	3.60	3.76	3.66	3.75
ethane	CH₃	s	0.87	0.85	0.85	0.81	0.80	0.79	0.83	0.82	0.85	0.85	0.85	0.82
ethanol	CH₃	t, 7	1.25	1.19	1.10	0.97	0.96	1.06	1.12	1.06	1.12	1.22	1.19	1.17
	CH₂	q, 7	3.72	3.66	3.51	3.36	3.34	3.51	3.57	3.44	3.54	3.71	3.60	3.65
	OH	s	1.32	1.33	3.30	0.83	0.50	1.39	3.39	4.63	2.47	-	-	-
ethyl acetate	CH₃CO	s	2.05	2.00	1.94	1.69	1.65	1.78	1.97	1.99	1.97	2.03	2.01	2.07
	CH₂CH₃	q, 7	4.12	4.08	4.04	3.87	3.89	3.96	4.05	4.03	4.06	4.14	4.09	4.14
	CH₂CH₃	t, 7	1.26	1.23	1.19	0.94	0.92	1.04	1.20	1.17	1.20	1.26	1.24	1.24
ethyl methyl ketone	CH₃CO	s	2.14	2.09	2.03	1.59	1.58	1.78	2.07	2.07	2.06	2.16	2.12	2.19
	CH₂CH₃	q, 7	2.46	2.43	2.39	1.82	1.81	2.06	2.45	2.43	2.43	2.49	2.5	3.18
	CH₂CH₃	t, 7	1.06	1.00	0.96	0.84	0.85	0.89	0.96	0.91	0.96	1.05	1.01	1.26
ethylene	CH₂	s	5.40	5.40	5.36	5.25	5.25	5.29	5.38	5.41	5.41	5.40	5.39	5.44
ethylene glycol	CH₂	s	3.76	3.66	3.48	3.36	3.41	3.58	3.28	3.34	3.51	3.72	3.59	3.65
furan	CH(2,5)	dd	7.45	7.46	7.48	7.10	7.13	7.24	7.56	7.67	7.52	7.44	7.49	7.57
furan	CH(3,4)	dd	6.40	6.41	6.37	6.07	6.08	6.19	6.43	6.47	6.44	6.42	6.40	6.51
H grease	CH₃	m	0.84–0.87	0.84–0.90	0.85–0.91	0.89–0.96	0.90–0.98	0.86–0.92	0.90	0.82–0.88	-	0.88–0.94	0.86–0.93	-
H grease	CH₂	br s	1.25	1.27	1.29	1.33	1.32	1.30	1.29	1.24	-	1.33	1.29	-
hexamethylbenzene	CH₃	s	2.24	2.20	2.18	2.10	2.13	2.10	2.17	2.14	2.19	2.24	2.19	-
hexamethyldisiloxane	CH₃	s	0.07	0.07	0.07	0.10	0.12	0.10	0.07	0.06	0.07	0.08	0.07	0.28
n-hexane	CH₃	t,7	0.88	0.89	0.89	0.88	0.89	0.85	0.88	0.86	0.89	0.91	0.90	-
n-hexane	CH₂	m	1.26	1.27	1.29	1.22	1.24	1.19	1.28	1.25	1.28	1.31	1.29	-
HMPA	CH₃	d, 9.50	2.65	2.60	2.58	2.42	2.40	2.47	2.59	2.53	2.57	2.63	2.64	2.61
hydrogen	H₂	s	4.62	4.59	4.55	4.50	4.47	4.49	4.54	4.61	4.57	4.53	4.56	-
imidazole	CH(2)	s	7.67	7.63	7.48	7.30	7.33	7.53	7.62	7.63	7.57	7.61	7.67	7.78
imidazole	CH(4,5)	s	7.1	7.07	6.94	6.86	6.90	7.01	7.04	7.01	7.01	7.03	7.05	7.14
methane	CH₄	s	0.22	0.21	0.19	0.17	0.16	0.15	0.17	0.20	0.20	0.18	0.20	0.18
methanol	CH₃	s	3.49	3.42	3.27	3.03	3.07	3.25	3.31	3.16	3.28	3.44	3.34	3.34
methanol	OH	s	1.09	1.09	3.02	-	-	1.30	3.12	4.01	2.16	-	-	-
nitromethane	CH₃	s	4.33	4.31	4.31	3.01	2.94	3.59	4.43	4.42	4.31	4.28	4.34	4.40
n-pentane	CH₃	t, 7	0.88	0.89	0.89	0.87	0.87	0.84	0.88	0.86	0.89	0.90	0.90	-
n-pentane	CH₂	m	1.27	1.30	1.31	1.25	1.23	1.23	1.27	1.27	1.29	1.33	1.29	-
propane	CH₃	t, 7.3	0.90	0.90	0.90	0.89	0.86	0.84	0.88	0.87	0.90	0.90	0.91	0.88
propane	CH₂	sept, 7.3	1.32	1.32	1.33	1.32	1.26	1.26	1.31	1.29	1.33	1.33	1.34	1.30
2-propanol	CH₃	d, 6	1.22	1.17	1.08	0.95	0.95	1.04	1.10	1.04	1.09	1.20	1.15	1.17
2-propanol	CH	sept, 6	4.04	3.97	3.82	3.65	3.67	3.82	3.90	3.78	3.87	4.05	3.92	4.02
propylene	CH₃	dt, 6.4, 1.5	1.73	1.71	1.69	1.55	1.55	1.58	1.68	1.68	1.70	1.70	1.70	1.70
	CH₂(1)	dm, 10	4.94	4.93	4.89	4.92	4.95	4.91	4.90	4.94	4.93	4.93	4.91	4.95
	CH₂(2)	dm, 17	5.03	5.03	4.99	4.98	5.01	4.98	5.00	5.03	5.04	5.03	5.01	5.06
	CH	m	5.83	5.84	5.79	5.70	5.72	5.72	5.81	5.80	5.85	5.87	5.82	5.90
pump oil	CH₃	m	0.83–0.89	0.84–0.89	0.86–0.90	0.88–0.96	0.91–0.97	0.88–0.91	0.87	0.74	0.85	0.99	0.86–0.91	-
pump oil	CH₂	br s	1.26	1.27	1.29	1.30	1.37	1.31	1.29	1.15	1.27	1.41	1.29	-
pyridine	CH(2,6)	m	8.62	8.59	8.54	8.47	8.53	8.51	8.58	8.58	8.57	8.45	8.53	8.52
	CH(3,5)	m	7.29	7.28	7.25	6.67	6.66	6.90	7.35	7.39	7.33	7.40	7.44	7.45
	CH(4)	m	7.68	7.68	7.65	6.99	6.98	7.25	7.76	7.79	7.73	7.82	7.85	7.87
pyrrole	NH	br t	8.40	8.69	9.96	7.71	7.80	8.61	10.02	10.75	9.27	-	-	-
	CH(2,5)	m	6.83	6.79	6.66	6.43	6.48	6.62	6.77	6.73	6.75	6.84	6.72	6.93
	CH(3,4)	m	6.26	6.19	6.02	6.27	6.37	6.27	6.07	6.01	6.10	6.24	6.08	6.26
pyrrolidine	CH₂(2,5)	m	2.87	2.82	2.75	2.54	2.54	2.64	-	2.67	2.75	3.11	2.80	3.07
pyrrolidine	CH₂(3,4)	m	1.68	1.67	1.59	1.36	1.33	1.43	-	1.55	1.61	1.93	1.72	1.87
silicone grease	CH₃	s	0.07	0.09	0.11	0.26	0.29	0.14	0.13	-0.06	0.08	0.16	0.1	-
tetrahydrofuran	CH₂(2,5)	m	3.76	3.69	3.62	3.54	3.57	3.59	3.63	3.60	3.64	3.78	3.71	3.74
tetrahydrofuran	CH₂(3,4)	m	1.85	1.82	1.79	1.43	1.40	1.55	1.79	1.76	1.8	1.91	1.87	1.88
toluene	CH₃	s	2.36	2.34	2.31	2.11	2.11	2.16	2.32	2.30	2.33	2.33	2.32	-
	CH(2,4,6)	m	7.17	7.15	7.10	6.96–7.01	7.02	7.01–7.08	7.10–7.20	7.18	7.10–7.30	7.10–7.30	7.16	-
	CH(3,5)	m	7.25	7.24	7.19	7.09	7.13	7.10–7.17	7.10–7.20	7.25	7.10–7.30	7.10–7.30	7.16	-
triethylamine	CH₃	t, 7	1.03	0.99	0.97	0.95	0.96	0.93	0.96	0.93	0.96	1.31	1.05	0.99
triethylamine	CH₂	q, 7	2.53	2.48	2.46	2.39	2.4	2.39	2.45	2.43	2.45	3.12	2.58	2.57

Gottlieb, H. E.; Kotlyar, V.; Nudelman, A. J. Org. Chem. 1997, 62, 7512-7515.
Fulmer, G. R.; Miller, A. J. M.; Sherden, N. H.; Gottlieb, H. E.; Nudelman, A.; Stoltz, B. M.; Bercaw, J. E.; Goldberg, K. I. Organometallics 2010, 29, 2176-2179.

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