NMR Spectroscopy

NMR Solvents
Solvent	Formula	¹H shifts	¹³C shifts	mp °C	bp °C
Acetic Acid-d₄	CD₃COOD	2.0, 11.7	20.0, 180.0	16.6	117.9
Acetone-d₆	CD₃COCD₃	2.09	29.9, 206.7	-94.7	56.1
Acetonitrile-d₃	CD₃CN	1.94	1.4, 118.7	-43.8	81.6
Benzene-d₆	C₆D₆	7.16	128.4	5.5	80.1
Carbon Disulphide	CS₂	none	192.8	-11.6	46.3
Carbon Tetrachloride	CCl₄	none	96.7	-23.0	76.8
Chloroform-d	CDCl₃	7.24	77.23	-63.5	61.3
Dichloromethane-d₂	CD₂Cl₂	5.32	54.0	-95.1	40.8
Diethyl Ether (-100 °C)	(CH₃CH₂)₂O	1.21, 3.45	?, 66.51	-116.3	34.6
Dimethyl Ether (-100 °C)	CH₃OCH₃	3.2	60.08	-138.5	-23
N,N-Dimethyl formamide-d₇	Me₂NCHO	2.95, 2.75, 8.03	29.8, 34.9, 163.2	-61.?	153.?
Dimethyl Sulfoxide-d₆	CD₃SOCD₃	2.50	39.5	18.6	189.0
1,4-Dioxane	(OCH₂CH₂)₂	3.53	66.7	11.8	101.4
Ethanol-d₆	CD₃CD₂OD	1.11, 3.56, 5.19	17.3, 57.0	-117	78.3
Methanol-d₄	CD₃OD	3.31, 4.78	49.2	-97.8	64.6
Nitrobenzene	C₆D₅NO₂	7.5, 7.7, 8.1	123, 129, 135	5.7	210.8
Nitromethane-d₃	CD₃NO₂	4.3	57.3	-28.6	101.2
Pyridine-d₅	C₅D₅N	7.22, 7.58, 8.74	123.9, 135.9, 150.2	-41.6	115.3
1,1,2,2-Tetrachloroethane	CHCl₂CHCl₂	5.96	75.5	-43.8	146.3
Tetrahydrofuran-d₈	C₄D₈O	1.73, 3.58	25.4, 67.6	-108.5	65.4
Tetrahydrofuran -100 °C	C₄H₈O		?, 67.96
Toluene-d₈	C₆D₅CD₃	2.09, 6.98, 7.00, 7.09	20.4, 125.5, 128.3, 129.4, 137.9	-94.9	110.6
Trichlorofluoromethane	CFCl₃	none	117.6	-111	23.7
Trifluoroacetic Acid-d₄	CF₃COOD	11.5	116.6, 164.2	-15.3	72.4
Trifluoroethanol-d₃	CF₃CD₂OD	3.88, 5.02	61.5, 126.3	-15.3	72.4
Water	D₂O	4.8	none	0.0	100.0
Solvent	Formula	¹H shifts	¹³C shifts	mp °C	bp °C

NMR Chemical Shifts of Common Laboratory Solvents as Trace Impurities, Gottlieb, H. E.; Kotlyar, V.; Nudelman, A. J. Org. Chem. 1997, 62 7512 - 7515. DOI