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4-Penten-1-one, 4-methyl-1-phenyl-5-(phenylthio)-, (E)-
SpectraBase Compound ID 7ndVidimwEW
InChI InChI=1S/C18H18OS/c1-15(14-20-17-10-6-3-7-11-17)12-13-18(19)16-8-4-2-5-9-16/h2-11,14H,12-13H2,1H3/b15-14+
InChIKey GPBBDFLBAZKEFE-CCEZHUSRSA-N
Mol Weight 282.4 g/mol
Molecular Formula C18H18OS
Exact Mass 282.107836 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E6LkoSscpx2
Name 4-Penten-1-one, 4-methyl-1-phenyl-5-(phenylthio)-, (E)-
CAS Registry Number 125417-43-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H18OS
InChI InChI=1S/C18H18OS/c1-15(14-20-17-10-6-3-7-11-17)12-13-18(19)16-8-4-2-5-9-16/h2-11,14H,12-13H2,1H3/b15-14+
InChIKey GPBBDFLBAZKEFE-CCEZHUSRSA-N
Molecular Weight 282.401 g/mol
SMILES c1(S\C=C\(CCC(=O)c2ccccc2)C)ccccc1
SPLASH splash10-0a4i-4910000000-580f7a7d307290d665d4
Source of Spectrum KC-1989-1634-9
Synonyms (4E)-4-methyl-1-phenyl-5-(phenylsulfanyl)-4-penten-1-one (E)-4-Methyl-1-phenyl-5-phenylthiopent-4-en-1-one
Wiley ID 1286217