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Ethyl 2-(5-methylthiophen-3-yl)acetate
SpectraBase Compound ID FlbpPKTMdFV
InChI InChI=1S/C9H12O2S/c1-3-11-9(10)5-8-4-7(2)12-6-8/h4,6H,3,5H2,1-2H3
InChIKey JXBHLUBJEBFTIT-UHFFFAOYSA-N
Mol Weight 184.25 g/mol
Molecular Formula C9H12O2S
Exact Mass 184.055801 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Dfl5r7P9oKv
Name Ethyl 2-(5-methylthiophen-3-yl)acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H12O2S
InChI InChI=1S/C9H12O2S/c1-3-11-9(10)5-8-4-7(2)12-6-8/h4,6H,3,5H2,1-2H3
InChIKey JXBHLUBJEBFTIT-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol201292v
Molecular Weight 184.253 g/mol
SMILES c1c(scc1CC(=O)OCC)C
SPLASH splash10-03e9-0900000000-bc9d219d06ef7a5a4072
Source of Spectrum A1-13-3640/SMSI9-3
Synonyms 2-(5-Methyl-3-thiophenyl)acetic acid ethyl ester Ethyl 2-(5-methyl-3-thienyl)acetate Ethyl 2-(5-methylthiophen-3-yl)ethanoate
Wiley ID 1753449