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2-Propenal, 2-methyl-3-phenyl-3-(2-propenylthio)-, (E)-
SpectraBase Compound ID YEgENEyxyz
InChI InChI=1S/C13H14OS/c1-3-9-15-13(11(2)10-14)12-7-5-4-6-8-12/h3-8,10H,1,9H2,2H3/b13-11+
InChIKey YNVKYHDIGKYJHZ-ACCUITESSA-N
Mol Weight 218.31 g/mol
Molecular Formula C13H14OS
Exact Mass 218.076536 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 51uUxZfzK4j
Name 2-Propenal, 2-methyl-3-phenyl-3-(2-propenylthio)-, (E)-
CAS Registry Number 130169-39-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14OS
InChI InChI=1S/C13H14OS/c1-3-9-15-13(11(2)10-14)12-7-5-4-6-8-12/h3-8,10H,1,9H2,2H3/b13-11+
InChIKey YNVKYHDIGKYJHZ-ACCUITESSA-N
Molecular Weight 218.314 g/mol
SMILES C(\C(=C/(c1ccccc1)SCC=C)C)=O
SPLASH splash10-0a4j-8910000000-0d71522da15c192e9835
Source of Spectrum K-123-1373-8
Synonyms (2E)-3-(allylsulfanyl)-2-methyl-3-phenyl-2-propenal 3-(allylthio)-2-methyl-3-phenyl-2-propenal
Wiley ID 1217669