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(3Z)-4-(phenylthio)hexa-3,5-dienoic acid
SpectraBase Compound ID DjXWvrgj7i3
InChI InChI=1S/C12H12O2S/c1-2-10(8-9-12(13)14)15-11-6-4-3-5-7-11/h2-8H,1,9H2,(H,13,14)/b10-8-
InChIKey FNXQNIOZJSIPAB-NTMALXAHSA-N
Mol Weight 220.29 g/mol
Molecular Formula C12H12O2S
Exact Mass 220.055801 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7myKyAFJjJp
Name (3Z)-4-(phenylthio)hexa-3,5-dienoic acid
CAS Registry Number 84132-29-6
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H12O2S
InChI InChI=1S/C12H12O2S/c1-2-10(8-9-12(13)14)15-11-6-4-3-5-7-11/h2-8H,1,9H2,(H,13,14)/b10-8-
InChIKey FNXQNIOZJSIPAB-NTMALXAHSA-N
Molecular Weight 220.286 g/mol
SMILES OC(C\C=C\(Sc1ccccc1)C=C)=O
SPLASH splash10-03di-0920000000-157a501285893104406a
Source of Spectrum J-48-473-0
Synonyms (3Z)-4-phenylsulfanylhexa-3,5-dienoic acid
Wiley ID 1219624