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Ethyl 4-(phenylthio)-2,4-hexadienoate
SpectraBase Compound ID Hb1cNqXAmKq
InChI InChI=1S/C14H16O2S/c1-3-12(10-11-14(15)16-4-2)17-13-8-6-5-7-9-13/h3,5-11H,4H2,1-2H3/b11-10+,12-3+
InChIKey NZFGHLUQWHIWJZ-ZLRCPBPQSA-N
Mol Weight 248.34 g/mol
Molecular Formula C14H16O2S
Exact Mass 248.087101 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JgH9ykR14JJ
Name Ethyl 4-(phenylthio)-2,4-hexadienoate
Alternate Name(s) Ethyl (2E,4E)-4-(phenylsulfanyl)-2,4-hexadienoate
CAS Registry Number 84132-39-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H16O2S
InChI InChI=1S/C14H16O2S/c1-3-12(10-11-14(15)16-4-2)17-13-8-6-5-7-9-13/h3,5-11H,4H2,1-2H3/b11-10+,12-3+
InChIKey NZFGHLUQWHIWJZ-ZLRCPBPQSA-N
Molecular Weight 248.340 g/mol
SMILES C(\C=C\C(Sc1ccccc1)=C/C)(=O)OCC
SPLASH splash10-03ka-0960000000-932547f10ab4181b0192
Source of Spectrum J-48-474-0
Wiley ID 1251009