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 161–240 of 1,285 · formula C5–C8 · page 3/17

Name	CAS	Formula	Slug
2-bromo-5-methoxybenzaldehyde	7507-86-0	C8H7BrO2	`2-bromo-5-methoxybenzaldehyde`
2-Bromo-m-xylene	576-22-7	C8H9Br	`2-bromo-m-xylene`
2-Bromo-p-xylene	35884-77-6	C8H9Br	`2-bromo-p-xylene`
2-Bromoacetophenone	70-11-1	C8H7BrO	`2-bromoacetophenone`
2-Bromoaniline	615-36-1	C6H6BrN	`2-bromoaniline`
2-Bromohexane	3377-86-4	C6H13Br	`2-bromohexane`
2-Bromohexanoic Acid	616-05-7	C6H11BrO2	`2-bromohexanoic-acid`
2-Bromoisovaleric acid	565-74-2	C5H9BrO2	`2-bromoisovaleric-acid`
2-Bromooctane	557-35-7	C8H17Br	`2-bromooctane`
2-bromoterephthalaldehyde	90001-43-7	C8H5BrO2	`2-bromoterephthalaldehyde`
2-Bromothiophenol	6320-02-1	C6H5BrS	`2-bromothiophenol`
2-Butylaminoethanol	111-75-1	C6H15NO	`2-butylaminoethanol`
2-Butylfuran	4466-24-4	C8H12O	`2-butylfuran`
2-Butyn-1-al diethyl acetal	2806-97-5	C8H14O2	`2-butyn-1-al-diethyl-acetal`
2-Carboethoxydithiolane	20461-99-8	C6H10O2S2	`2-carboethoxydithiolane`
2-Carboxythiazolidine-4-carboxylic acid	30097-06-4	C5H7NO4S	`2-carboxythiazolidine-4-carboxylic-acid`
2-chloro-1H-indole	7135-31-1	C8H6ClN	`2-chloro-1h-indole`
2-Chloro-2-methylbutane	594-36-5	C5H11Cl	`2-chloro-2-methylbutane`
2-Chloro-3-cyanopyridine	6602-54-6	C6H3ClN2	`2-chloro-3-cyanopyridine`
2-Chloro-3-hydroxypyridine	6636-78-8	C5H4ClNO	`2-chloro-3-hydroxypyridine`
2-Chloro-3-methylbenzoic acid	15068-35-6	C8H7ClO2	`2-chloro-3-methylbenzoic-acid`
2-Chloro-4-methylpentanoic acid	29671-29-2	C6H11ClO2	`2-chloro-4-methylpentanoic-acid`
2-Chloro-5-(chloromethyl)thiophene	23784-96-5	C5H4Cl2S	`2-chloro-5-chloromethylthiophene`
2-Chloro-5-(trifluoromethyl)benzonitrile	328-87-0	C8H3ClF3N	`2-chloro-5-trifluoromethylbenzonitrile`
2-Chloro-5-(trifluoromethyl)pyridine	52334-81-3	C6H3ClF3N	`2-chloro-5-trifluoromethylpyridine`
2-Chloro-5-aminophenol	6358-06-1	C6H6ClNO	`2-chloro-5-aminophenol`
2-Chloro-5-Methylbenzoic Acid	6342-60-5	C8H7ClO2	`2-chloro-5-methylbenzoic-acid`
2-Chloro-p-xylene	95-72-7	C8H9Cl	`2-chloro-p-xylene`
2-Chloroaniline	95-51-2	C6H6ClN	`2-chloroaniline`
2-Chlorobenzenesulfonamide	6961-82-6	C6H6ClNO2S	`2-chlorobenzenesulfonamide`
2-Chlorohexane	638-28-8	C6H13Cl	`2-chlorohexane`
2-Chloronicotinamide	10366-35-5	C6H5ClN2O	`2-chloronicotinamide`
2-Chlorophenol	95-57-8	C6H5ClO	`2-chlorophenol`
2-Chlorophenoxyacetic Acid	614-61-9	C8H7ClO3	`2-chlorophenoxyacetic-acid`
2-Chlorostyrene	2039-87-4	C8H7Cl	`2-chlorostyrene`
2-Cyclohexen-1-Ol	822-67-3	C6H10O	`2-cyclohexen-1-ol`
2-Cyclohexylethanol	4442-79-9	C8H16O	`2-cyclohexylethanol`
2-Cyclopenten-1-One	930-30-3	C5H6O	`2-cyclopenten-1-one`
2-Diisopropylaminoethanol	96-80-0	C8H19NO	`2-diisopropylaminoethanol`
2-Ethoxyethyl isobutyrate	54396-97-3	C8H16O3	`2-ethoxyethyl-isobutyrate`
2-Ethyl-1-Hexene	1632-16-2	C8H16	`2-ethyl-1-hexene`
2-Ethyl-4-methylpentan-1-ol	106-67-2	C8H18O	`2-ethyl-4-methylpentan-1-ol`
2-Ethylaniline	578-54-1	C8H11N	`2-ethylaniline`
2-Ethylbutanal	97-96-1	C6H12O	`2-ethylbutanal`
2-Ethylbutyl acetate	10031-87-5	C8H16O2	`2-ethylbutyl-acetate`
2-Ethylbutylamine	617-79-8	C6H15N	`2-ethylbutylamine`
2-Ethylbutyric Acid	88-09-5	C6H12O2	`2-ethylbutyric-acid`
2-Ethylhexan-1-ol	104-76-7	C8H18O	`2-ethylhexan-1-ol`
2-Ethylhexanoyl chloride	760-67-8	C8H15ClO	`2-ethylhexanoyl-chloride`
2-Ethylphenol	90-00-6	C8H10O	`2-ethylphenol`
2-Fluoro-4-(trifluoromethyl)benzonitrile	146070-34-0	C8H3F4N	`2-fluoro-4-trifluoromethylbenzonitrile`
2-Fluoro-4-methoxybenzaldehyde	331-64-6	C8H7FO2	`2-fluoro-4-methoxybenzaldehyde`
2-fluoro-4-methoxybenzonitrile	94610-82-9	C8H6FNO	`2-fluoro-4-methoxybenzonitrile`
2-Fluoro-4-methylpyridine	461-87-0	C6H6FN	`2-fluoro-4-methylpyridine`
2-Fluoroaniline	348-54-9	C6H6FN	`2-fluoroaniline`
2-Fluorophenylboronic acid	1993-03-9	C6H6BFO2	`2-fluorophenylboronic-acid`
2-Furoic Acid	88-14-2	C5H4O3	`2-furoic-acid`
2-Hexyloxirane	2984-50-1	C8H16O	`2-hexyloxirane`
2-Hexynoic acid	764-33-0	C6H8O2	`2-hexynoic-acid`
2-Hydrazinopyridine	4930-98-7	C5H7N3	`2-hydrazinopyridine`
2-Hydroxy-2-methylbutyric acid	3739-30-8	C5H10O3	`2-hydroxy-2-methylbutyric-acid`
2-Hydroxy-3-methylbenzaldehyde	824-42-0	C8H8O2	`2-hydroxy-3-methylbenzaldehyde`
2-Hydroxy-3-methylbutanoic acid	4026-18-0	C5H10O3	`2-hydroxy-3-methylbutanoic-acid`
2-Hydroxy-4-methylvaleric acid	498-36-2	C6H12O3	`2-hydroxy-4-methylvaleric-acid`
2-Hydroxy-5-methylpyridine	1003-68-5	C6H7NO	`2-hydroxy-5-methylpyridine`
2-Hydroxy-p-toluic acid	50-85-1	C8H8O3	`2-hydroxy-p-toluic-acid`
2-Hydroxycyclohexanol	931-17-9	C6H12O2	`2-hydroxycyclohexanol`
2-Hydroxyethyl Acrylate	818-61-1	C5H8O3	`2-hydroxyethyl-acrylate`
2-Hydroxyhexanoic acid	6064-63-7	C6H12O3	`2-hydroxyhexanoic-acid`
2-Hydroxyoctanoic acid	617-73-2	C8H16O3	`2-hydroxyoctanoic-acid`
2-Hydroxyphenylacetic acid	614-75-5	C8H8O3	`2-hydroxyphenylacetic-acid`
2-Hydroxypyridine	142-08-5	C5H5NO	`2-hydroxypyridine`
2-Hydroxythiophenol	1121-24-0	C6H6OS	`2-hydroxythiophenol`
2-Iodo-6-methylpyridin-3-ol	23003-30-7	C6H6INO	`2-iodo-6-methylpyridin-3-ol`
2-Iodophenol	533-58-4	C6H5IO	`2-iodophenol`
2-Iodopyridin-3-ol	40263-57-8	C5H4INO	`2-iodopyridin-3-ol`
2-Isobutoxyethanol	4439-24-1	C6H14O2	`2-isobutoxyethanol`
2-Isobutyl-4-methylthiazole	61323-24-8	C8H13NS	`2-isobutyl-4-methylthiazole`
2-Methoxy-5-methylaniline	120-71-8	C8H11NO	`2-methoxy-5-methylaniline`
2-Methoxy-5-methylphenol	1195-09-1	C8H10O2	`2-methoxy-5-methylphenol`

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).