SpectraBase Spectrum ID |
7RlJWpvKyiP |
Name |
3-[(4-Methylphenyl)sulfanyl]propanoic Acid Ethyl Ester |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C12H16O2S |
InChI |
InChI=1S/C12H16O2S/c1-3-14-12(13)8-9-15-11-6-4-10(2)5-7-11/h4-7H,3,8-9H2,1-2H3 |
InChIKey |
JHQSBVMORQJICP-UHFFFAOYSA-N |
Literature Reference DOI |
10.1021/ol2010962 |
Molecular Weight |
224.318 g/mol |
SMILES |
c1cc(SCCC(OCC)=O)ccc1C |
SPLASH |
splash10-00di-1290000000-df2e9a2acc5a3cfa67e1 |
Source of Spectrum |
A1-13-3170/SMS4-4ab |
Synonyms |
Ethyl 3-(p-tolylthio)propanoate
3-[(4-methylphenyl)thio]propanoic acid ethyl ester
Ethyl 3-(p-tolylsulfanyl)propanoate
Ethyl 3-(4-methylphenyl)sulfanylpropanoate |
Wiley ID |
1753325 |