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Ethyl 3-hydroxy-5-phenyl-4-pentenedithioate
SpectraBase Compound ID FzK6mWkG2EI
InChI InChI=1S/C13H16OS2/c1-2-16-13(15)10-12(14)9-8-11-6-4-3-5-7-11/h3-9,12,14H,2,10H2,1H3/b9-8+
InChIKey NRDGHBLKZLWZMY-CMDGGOBGSA-N
Mol Weight 252.39 g/mol
Molecular Formula C13H16OS2
Exact Mass 252.064257 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JEVNb6u5nyA
Name Ethyl 3-hydroxy-5-phenyl-4-pentenedithioate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16OS2
InChI InChI=1S/C13H16OS2/c1-2-16-13(15)10-12(14)9-8-11-6-4-3-5-7-11/h3-9,12,14H,2,10H2,1H3/b9-8+
InChIKey NRDGHBLKZLWZMY-CMDGGOBGSA-N
Molecular Weight 252.390 g/mol
SMILES OC(CC(SCC)=S)\C=C\c1ccccc1
SPLASH splash10-0006-9820000000-09373d8bb701a142613f
Source of Spectrum AJ-72-815-4
Synonyms Ethyl (E)-3-hydroxy-5-phenyl-4-pentenedithioate Ethyl (4E)-3-hydroxy-5-phenyl-4-pentenedithioate
Wiley ID 775004