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.
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Showing 801–880 of 1,113 · names starting with digits/symbols · page 11/14
| Name | CAS | Formula | Slug |
|---|---|---|---|
| 4-(Trifluoromethyl)benzylamine | 3300-51-4 | C8H8F3N | 4-trifluoromethylbenzylamine |
| 4-(Trifluoromethyl)phenol | 402-45-9 | C7H5F3O | 4-trifluoromethylphenol |
| 4-(Trimethylsilyl)morpholine | 13368-42-8 | C7H17NOSi | 4-trimethylsilylmorpholine |
| 4-Acetamidobenzenesulfonamide | 121-61-9 | C8H10N2O3S | 4-acetamidobenzenesulfonamide |
| 4-Acetamidobutyric acid | 3025-96-5 | C6H11NO3 | 4-acetamidobutyric-acid |
| 4-Acetamidothiophenol | 1126-81-4 | C8H9NOS | 4-acetamidothiophenol |
| 4-Acetyl-1-methylcyclohexene | 6090-09-1 | C9H14O | 4-acetyl-1-methylcyclohexene |
| 4-Acetylbutyric acid | 3128-06-1 | C6H10O3 | 4-acetylbutyric-acid |
| 4-Amino-1-[5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one | 790299-36-4 | C9H13N3O3 | 4-amino-1-5-hydroxymethyloxolan-2-ylpyrimidin-2-one |
| 4-Amino-1H-imidazole-5-carboxamide | 360-97-4 | C4H6N4O | 4-amino-1h-imidazole-5-carboxamide |
| 4-Amino-2-(trifluoromethyl)benzonitrile | 654-70-6 | C8H5F3N2 | 4-amino-2-trifluoromethylbenzonitrile |
| 4-Amino-3-hydroxybutanoic acid | 924-49-2 | C4H9NO3 | 4-amino-3-hydroxybutanoic-acid |
| 4-Amino-3-methylbenzoic acid | 2486-70-6 | C8H9NO2 | 4-amino-3-methylbenzoic-acid |
| 4-amino-5-chloro-2-ethoxybenzoic acid | 108282-38-8 | C9H10ClNO3 | 4-amino-5-chloro-2-ethoxybenzoic-acid |
| 4-Amino-6-chloro-2-methylthiopyrimidine | 1005-38-5 | C5H6ClN3S | 4-amino-6-chloro-2-methylthiopyrimidine |
| 4-Amino-o-xylene | 95-64-7 | C8H11N | 4-amino-o-xylene |
| 4-Aminoacetanilide | 122-80-5 | C8H10N2O | 4-aminoacetanilide |
| 4-Aminobutyraldehyde dimethyl acetal | 19060-15-2 | C6H15NO2 | 4-aminobutyraldehyde-dimethyl-acetal |
| 4-Aminocyclohexanol | 6850-65-3 | C6H13NO | 4-aminocyclohexanol |
| 4-Aminohippuric acid | 61-78-9 | C9H10N2O3 | 4-aminohippuric-acid |
| 4-aminophenol | 123-30-8 | C6H7NO | 4-aminophenol |
| 4-Aminoveratrole | 6315-89-5 | C8H11NO2 | 4-aminoveratrole |
| 4-Bromo-1-Butene | 5162-44-7 | C4H7Br | 4-bromo-1-butene |
| 4-Bromo-1-chloro-2-fluorobenzene | 60811-18-9 | C6H3BrClF | 4-bromo-1-chloro-2-fluorobenzene |
| 4-bromo-1H-indole-3-carbaldehyde | 98600-34-1 | C9H6BrNO | 4-bromo-1h-indole-3-carbaldehyde |
| 4-Bromo-2-chlorobenzoic acid | 59748-90-2 | C7H4BrClO2 | 4-bromo-2-chlorobenzoic-acid |
| 4-Bromo-2-fluorophenol | 2105-94-4 | C6H4BrFO | 4-bromo-2-fluorophenol |
| 4-Bromo-2-methylanisole | 14804-31-0 | C8H9BrO | 4-bromo-2-methylanisole |
| 4-Bromo-m-xylene | 583-70-0 | C8H9Br | 4-bromo-m-xylene |
| 4-Bromoaniline | 106-40-1 | C6H6BrN | 4-bromoaniline |
| 4-Bromobenzohydrazide | 5933-32-4 | C7H7BrN2O | 4-bromobenzohydrazide |
| 4-Bromobenzoic acid | 586-76-5 | C7H5BrO2 | 4-bromobenzoic-acid |
| 4-Bromobenzyl alcohol | 873-75-6 | C7H7BrO | 4-bromobenzyl-alcohol |
| 4-Bromobutyric acid | 2623-87-2 | C4H7BrO2 | 4-bromobutyric-acid |
| 4-Bromoisophthalic acid | 6939-93-1 | C8H5BrO4 | 4-bromoisophthalic-acid |
| 4-Bromophenacyl bromide | 99-73-0 | C8H6Br2O | 4-bromophenacyl-bromide |
| 4-Bromophenethylamine | 73918-56-6 | C8H10BrN | 4-bromophenethylamine |
| 4-Bromophenol | 106-41-2 | C6H5BrO | 4-bromophenol |
| 4-Bromoresorcinol | 6626-15-9 | C6H5BrO2 | 4-bromoresorcinol |
| 4-Bromoresorcinol dimethyl ether | 17715-69-4 | C8H9BrO2 | 4-bromoresorcinol-dimethyl-ether |
| 4-Bromothiobenzamide | 26197-93-3 | C7H6BrNS | 4-bromothiobenzamide |
| 4-Bromoveratrole | 2859-78-1 | C8H9BrO2 | 4-bromoveratrole |
| 4-Chloro-1-Naphthol | 604-44-4 | C10H7ClO | 4-chloro-1-naphthol |
| 4-Chloro-2-fluoro-1-iodobenzene | 6797-79-1 | C6H3ClFI | 4-chloro-2-fluoro-1-iodobenzene |
| 4-Chloro-4'-fluorobutyrophenone | 3874-54-2 | C10H10ClFO | 4-chloro-4-fluorobutyrophenone |
| 4-Chloro-m-Phenylenediamine | 5131-60-2 | C6H7ClN2 | 4-chloro-m-phenylenediamine |
| 4-Chloro-n-ethylbenzenamine | 13519-75-0 | C8H10ClN | 4-chloro-n-ethylbenzenamine |
| 4-Chloro-o-xylene | 615-60-1 | C8H9Cl | 4-chloro-o-xylene |
| 4-Chloroaniline | 106-47-8 | C6H6ClN | 4-chloroaniline |
| 4-Chlorobenzonitrile | 623-03-0 | C7H4ClN | 4-chlorobenzonitrile |
| 4-Chlorobenzotrichloride | 5216-25-1 | C7H4Cl4 | 4-chlorobenzotrichloride |
| 4-Chlorobenzoyl Chloride | 122-01-0 | C7H4Cl2O | 4-chlorobenzoyl-chloride |
| 4-Chlorobenzyl cyanide | 140-53-4 | C8H6ClN | 4-chlorobenzyl-cyanide |
| 4-Chlorobutyl acetate | 6962-92-1 | C6H11ClO2 | 4-chlorobutyl-acetate |
| 4-Chlorobutyl phenyl ether | 2651-46-9 | C10H13ClO | 4-chlorobutyl-phenyl-ether |
| 4-Chlorobutyryl chloride | 4635-59-0 | C4H6Cl2O | 4-chlorobutyryl-chloride |
| 4-Chlorocatechol | 2138-22-9 | C6H5ClO2 | 4-chlorocatechol |
| 4-Chloroisatin | 6344-05-4 | C8H4ClNO2 | 4-chloroisatin |
| 4-Chlorophenol | 106-48-9 | C6H5ClO | 4-chlorophenol |
| 4-Chlorophenylacetic acid | 1878-66-6 | C8H7ClO2 | 4-chlorophenylacetic-acid |
| 4-Chlorostyrene | 1073-67-2 | C8H7Cl | 4-chlorostyrene |
| 4-Chromanol | 1481-93-2 | C9H10O2 | 4-chromanol |
| 4-Chromanone | 491-37-2 | C9H8O2 | 4-chromanone |
| 4-Cyanobenzaldehyde | 105-07-7 | C8H5NO | 4-cyanobenzaldehyde |
| 4-Cyanoindole | 16136-52-0 | C9H6N2 | 4-cyanoindole |
| 4-Cyclohexylbutanoic acid | 4441-63-8 | C10H18O2 | 4-cyclohexylbutanoic-acid |
| 4-Decanone | 624-16-8 | C10H20O | 4-decanone |
| 4-Dimethylaminobromobenzene | 586-77-6 | C8H10BrN | 4-dimethylaminobromobenzene |
| 4-Ethyl-1-octyn-3-ol | 5877-42-9 | C10H18O | 4-ethyl-1-octyn-3-ol |
| 4-Ethylamino-1-butanol | 39216-86-9 | C6H15NO | 4-ethylamino-1-butanol |
| 4-Ethylaniline | 589-16-2 | C8H11N | 4-ethylaniline |
| 4-Ethylbenzoic Acid | 619-64-7 | C9H10O2 | 4-ethylbenzoic-acid |
| 4-Ethylcatechol | 1124-39-6 | C8H10O2 | 4-ethylcatechol |
| 4-Ethylcyclohexanone | 5441-51-0 | C8H14O | 4-ethylcyclohexanone |
| 4-Ethylheptane | 2216-32-2 | C9H20 | 4-ethylheptane |
| 4-Ethylmorpholine | 100-74-3 | C6H13NO | 4-ethylmorpholine |
| 4-Ethylphenol | 123-07-9 | C8H10O | 4-ethylphenol |
| 4-Ethylphenyl acetate | 3245-23-6 | C10H12O2 | 4-ethylphenyl-acetate |
| 4-Ethyltoluene | 622-96-8 | C9H12 | 4-ethyltoluene |
| 4-Fluoro-2-(trifluoromethyl)benzoic acid | 141179-72-8 | C8H4F4O2 | 4-fluoro-2-trifluoromethylbenzoic-acid |
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).