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(Z)-3-Methyl-5-thiophen-3-ylpent-2-enoic acid ethyl ester
SpectraBase Compound ID A91QAMY0o0r
InChI InChI=1S/C12H16O2S/c1-3-14-12(13)8-10(2)4-5-11-6-7-15-9-11/h6-9H,3-5H2,1-2H3/b10-8-
InChIKey VYWYSHWFTNOEFB-NTMALXAHSA-N
Mol Weight 224.32 g/mol
Molecular Formula C12H16O2S
Exact Mass 224.087101 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID OS5nIeY5A4
Name (Z)-3-Methyl-5-thiophen-3-ylpent-2-enoic 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)8-10(2)4-5-11-6-7-15-9-11/h6-9H,3-5H2,1-2H3/b10-8-
InChIKey VYWYSHWFTNOEFB-NTMALXAHSA-N
Instrument Name Thermo DSQ II
Ionization Type EI
Literature Reference DOI 10.1002/jsfa.3696
Molecular Weight 224.318 g/mol
SMILES C(\C=C/(CCc1cscc1)C)(=O)OCC
SPLASH splash10-0002-9600000000-226f282ae21c355f43c7
Source of Spectrum SFA-89-2093-(Z)-20
Wiley ID 1840267