NMR Compound Spectrum Catalog

Experimental ¹H / ¹³C pages for common laboratory compounds. Filter by letter or carbon count, then open a compound for peak tables and stick spectra. Also try ¹H prediction and ¹³C prediction.

Browse All 2593

A–ZA 93 B 92 C 104 D 199 E 103 F 17 G 32 H 53 I 83 J 1 K 3 L 15 M 143 N 101 O 39 P 149 Q 4 R 5 S 37 T 133 U 41 V 30WX 2YZ 1 # 1113

CarbonsC1–C4 539 C5–C8 1285 C9–C12 768 C13–C18 1C19+

Showing 481–560 of 1,113 · names starting with digits/symbols · page 7/14

Name	CAS	Formula	Slug
2-Methyl-2-Butanethiol	1679-09-0	C5H12S	`2-methyl-2-butanethiol`
2-Methyl-2-Butanol	75-85-4	C5H12O	`2-methyl-2-butanol`
2-Methyl-2-Hexanol	625-23-0	C7H16O	`2-methyl-2-hexanol`
2-methyl-2-phenylpropanoic acid	826-55-1	C10H12O2	`2-methyl-2-phenylpropanoic-acid`
2-Methyl-3-(trifluoromethyl)aniline	54396-44-0	C8H8F3N	`2-methyl-3-trifluoromethylaniline`
2-Methyl-3-buten-1-ol	4516-90-9	C5H10O	`2-methyl-3-buten-1-ol`
2-Methyl-3-Buten-2-Ol	115-18-4	C5H10O	`2-methyl-3-buten-2-ol`
2-Methyl-3-Butenenitrile	16529-56-9	C5H7N	`2-methyl-3-butenenitrile`
2-Methyl-3-Butyn-2-Ol	115-19-5	C5H8O	`2-methyl-3-butyn-2-ol`
2-Methyl-3-Heptanone	2371-19-9	C8H16O	`2-methyl-3-heptanone`
2-Methyl-3-octanol	26533-34-6	C9H20O	`2-methyl-3-octanol`
2-Methyl-3-Pentanol	565-67-3	C6H14O	`2-methyl-3-pentanol`
2-Methyl-3-propylpyrazine	15986-80-8	C8H12N2	`2-methyl-3-propylpyrazine`
2-Methyl-3-thiosemicarbazide	6938-68-7	C2H7N3S	`2-methyl-3-thiosemicarbazide`
2-Methyl-4-heptanone	626-33-5	C8H16O	`2-methyl-4-heptanone`
2-Methyl-4-pentenoic acid	1575-74-2	C6H10O2	`2-methyl-4-pentenoic-acid`
2-Methyl-4(3H)-quinazolinone	1769-24-0	C9H8N2O	`2-methyl-43h-quinazolinone`
2-Methyl-5-(1-methylethenyl)cyclohexanol	619-01-2	C10H18O	`2-methyl-5-1-methylethenylcyclohexanol`
2-Methyl-5-vinylpyridine	140-76-1	C8H9N	`2-methyl-5-vinylpyridine`
2-Methylanisole	578-58-5	C8H10O	`2-methylanisole`
2-Methylbenzaldehyde	529-20-4	C8H8O	`2-methylbenzaldehyde`
2-Methylbenzoselenazole	2818-88-4	C8H7NSe	`2-methylbenzoselenazole`
2-Methylbenzothiazole	120-75-2	C8H7NS	`2-methylbenzothiazole`
2-Methylbenzoxazole	95-21-6	C8H7NO	`2-methylbenzoxazole`
2-Methylbenzyl alcohol	89-95-2	C8H10O	`2-methylbenzyl-alcohol`
2-Methylbutanoic acid	116-53-0	C5H10O2	`2-methylbutanoic-acid`
2-Methylbutyraldehyde	96-17-3	C5H10O	`2-methylbutyraldehyde`
2-Methylfuran	534-22-5	C5H6O	`2-methylfuran`
2-Methylglutaric Acid	18069-17-5	C6H10O4	`2-methylglutaric-acid`
2-Methylimidazole	693-98-1	C4H6N2	`2-methylimidazole`
2-Methylindole	95-20-5	C9H9N	`2-methylindole`
2-Methylnaphthalene	91-57-6	C11H10	`2-methylnaphthalene`
2-Methylnonane	871-83-0	C10H22	`2-methylnonane`
2-Methylpentanal	123-15-9	C6H12O	`2-methylpentanal`
2-Methylphenyl isothiocyanate	614-69-7	C8H7NS	`2-methylphenyl-isothiocyanate`
2-Methylpiperidine	109-05-7	C6H13N	`2-methylpiperidine`
2-Methylpropanal diethyl acetal	1741-41-9	C8H18O2	`2-methylpropanal-diethyl-acetal`
2-methylpropyl 2-ethylbutanoate	74082-06-7	C10H20O2	`2-methylpropyl-2-ethylbutanoate`
2-Methylpyrazine	109-08-0	C5H6N2	`2-methylpyrazine`
2-methylquinolin-6-amine	65079-19-8	C10H10N2	`2-methylquinolin-6-amine`
2-Methylquinoline	91-63-4	C10H9N	`2-methylquinoline`
2-Methylquinoxaline	7251-61-8	C9H8N2	`2-methylquinoxaline`
2-Methylstyrene	611-15-4	C9H10	`2-methylstyrene`
2-Methylsuccinic acid	498-21-5	C5H8O4	`2-methylsuccinic-acid`
2-Methyltetrahydrofuran	96-47-9	C5H10O	`2-methyltetrahydrofuran`
2-Methyltetrahydrofuran-3-One	3188-00-9	C5H8O2	`2-methyltetrahydrofuran-3-one`
2-methyltetrahydroquinoline	1780-19-4	C10H13N	`2-methyltetrahydroquinoline`
2-Naphthaldehyde	66-99-9	C11H8O	`2-naphthaldehyde`
2-Naphthalenemethanol	1592-38-7	C11H10O	`2-naphthalenemethanol`
2-Naphthalenesulfonyl chloride	93-11-8	C10H7ClO2S	`2-naphthalenesulfonyl-chloride`
2-Naphthoic acid	93-09-4	C11H8O2	`2-naphthoic-acid`
2-Naphthol	135-19-3	C10H8O	`2-naphthol`
2-Naphthylamine	91-59-8	C10H9N	`2-naphthylamine`
2-Nonanone	821-55-6	C9H18O	`2-nonanone`
2-Octanone	111-13-7	C8H16O	`2-octanone`
2-Oxoadipic acid	3184-35-8	C6H8O5	`2-oxoadipic-acid`
2-oxobutanoic acid	600-18-0	C4H6O3	`2-oxobutanoic-acid`
2-Oxopentanedioic acid	328-50-7	C5H6O5	`2-oxopentanedioic-acid`
2-Oxopentanoic acid	1821-02-9	C5H8O3	`2-oxopentanoic-acid`
2-Pentanol	6032-29-7	C5H12O	`2-pentanol`
2-Pentanone	107-87-9	C5H10O	`2-pentanone`
2-Phenoxyacetohydrazide	4664-55-5	C8H10N2O2	`2-phenoxyacetohydrazide`
2-Phenoxyethanol	122-99-6	C8H10O2	`2-phenoxyethanol`
2-Phenoxypropionyl chloride	122-35-0	C9H9ClO2	`2-phenoxypropionyl-chloride`
2-Phenyl-2-propanol	617-94-7	C9H12O	`2-phenyl-2-propanol`
2-Phenyl-3-butyn-2-ol	127-66-2	C10H10O	`2-phenyl-3-butyn-2-ol`
2-Phenylacetamide	103-81-1	C8H9NO	`2-phenylacetamide`
2-Phenylbutyric acid	90-27-7	C10H12O2	`2-phenylbutyric-acid`
2-Phenylbutyryl chloride	36854-57-6	C10H11ClO	`2-phenylbutyryl-chloride`
2-Phenylethanol	60-12-8	C8H10O	`2-phenylethanol`
2-Phenylethyl formate	104-62-1	C9H10O2	`2-phenylethyl-formate`
2-Phenylglycine	69-91-0	C8H9NO2	`2-phenylglycine`
2-Phenylimidazole	670-96-2	C9H8N2	`2-phenylimidazole`
2-Phenylpropionic acid	492-37-5	C9H10O2	`2-phenylpropionic-acid`
2-Phenylpropionitrile	1823-91-2	C9H9N	`2-phenylpropionitrile`
2-Phenylpropylamine	582-22-9	C9H13N	`2-phenylpropylamine`
2-Piperidinemethanol	3433-37-2	C6H13NO	`2-piperidinemethanol`
2-Propoxyphenol	6280-96-2	C9H12O2	`2-propoxyphenol`
2-Propyl-2-imidazoline	15450-05-2	C6H12N2	`2-propyl-2-imidazoline`
2-Propylaniline	1821-39-2	C9H13N	`2-propylaniline`

References & data sources

NMRShiftDB2 — open experimental NMR chemical shift database.
Steinbeck, C.; Kuhn, S. NMRShiftDB — nmrshiftdb.nmr.uni-koeln.de
Gottlieb, H. E.; Kotlyar, V.; Nudelman, A. NMR Chemical Shifts of Common Laboratory Solvents as Trace Impurities. J. Org. Chem. 1997, 62, 7512–7515.
Fulmer, G. R. et al. NMR Chemical Shifts of Trace Impurities. Organometallics 2010, 29, 2176–2179.
PubChem — compound identifiers and structure depictions (NIH/NCBI).
Related tools: nmrdb.org (community NMR prediction reference).