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(3E,5E)-3-(Ethoxycarbonyl)-6-thiophenyl-3,5-hexadienoic acid
SpectraBase Compound ID AMIObE7Gkzz
InChI InChI=1S/C15H16O4S/c1-2-19-15(18)12(11-14(16)17)7-6-10-20-13-8-4-3-5-9-13/h3-10H,2,11H2,1H3,(H,16,17)/b10-6+,12-7+
InChIKey YPRPSXIGILCUAL-QXZILWSFSA-N
Mol Weight 292.35 g/mol
Molecular Formula C15H16O4S
Exact Mass 292.07693 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8nErGNG9Eto
Name (3E,5E)-3-(Ethoxycarbonyl)-6-thiophenyl-3,5-hexadienoic acid
Alternate Name(s) (3E,5E)-3-(ethoxycarbonyl)-6-(phenylsulfanyl)-3,5-hexadienoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H16O4S
InChI InChI=1S/C15H16O4S/c1-2-19-15(18)12(11-14(16)17)7-6-10-20-13-8-4-3-5-9-13/h3-10H,2,11H2,1H3,(H,16,17)/b10-6+,12-7+
InChIKey YPRPSXIGILCUAL-QXZILWSFSA-N
Molecular Weight 292.349 g/mol
SMILES OC(C\C(C(=O)OCC)=C/C=C/Sc1ccccc1)=O
SPLASH splash10-01vx-1940000000-f65157bb5089fbdbfb5d
Source of Spectrum J-66-7886-3
Wiley ID 1568486