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methyl (2E)-3-fluoro-3-[(2-oxo-2-phenylethyl)sulfanyl]-2-(trifluoromethyl)-2-propenoate
SpectraBase Compound ID Fj1XasRwbiM
InChI InChI=1S/C13H10F4O3S/c1-20-12(19)10(13(15,16)17)11(14)21-7-9(18)8-5-3-2-4-6-8/h2-6H,7H2,1H3/b11-10+
InChIKey JSPIOVVKZQUJIL-ZHACJKMWSA-N
Mol Weight 322.27 g/mol
Molecular Formula C13H10F4O3S
Exact Mass 322.028678 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GPeb18F6m84
Name Methyl (2E)-3-fluoro-3-[(2-oxo-2-phenylethyl)sulfanyl]-2-(trifluoromethyl)-2-propenoate
CAS Registry Number 329735-34-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H10F4O3S
InChI InChI=1S/C13H10F4O3S/c1-20-12(19)10(13(15,16)17)11(14)21-7-9(18)8-5-3-2-4-6-8/h2-6H,7H2,1H3/b11-10+
InChIKey JSPIOVVKZQUJIL-ZHACJKMWSA-N
Molecular Weight 322.274 g/mol
SMILES C(S\C(=C\(C(F)(F)F)C(=O)OC)F)C(c1ccccc1)=O
SPLASH splash10-0a4i-8900000000-9af49c5bac6a8075bd2a
Synonyms (E)-3-fluoro-3-(phenacylthio)-2-(trifluoromethyl)-2-propenoic acid methyl ester (E)-3-fluoro-3-(phenacylthio)-2-(trifluoromethyl)acrylic acid methyl ester 3-Fluoro-3-(2-oxo-2-phenyl-ethylsulfanyl)-2-trifluoromethyl-acrylic acid methyl ester Methyl (E)-3-fluoranyl-3-phenacylsulfanyl-2-(trifluoromethyl)prop-2-enoate Methyl (E)-3-fluoro-3-phenacylsulfanyl-2-(trifluoromethyl)prop-2-enoate
Wiley ID 1463102