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2-Butanone, 1-phenyl-3-(phenylthio)-

View entire compound with spectra: 2 MS (GC)

2-Butanone, 1-phenyl-3-(phenylthio)-
SpectraBase Compound ID 8zbrmSo9J8T
InChI InChI=1S/C16H16OS/c1-13(18-15-10-6-3-7-11-15)16(17)12-14-8-4-2-5-9-14/h2-11,13H,12H2,1H3
InChIKey KVDIHESSODUOSD-UHFFFAOYSA-N
Mol Weight 256.36 g/mol
Molecular Formula C16H16OS
Exact Mass 256.092186 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JmGz2dlOzhH
Name 2-Butanone, 1-phenyl-3-(phenylthio)-
CAS Registry Number 95110-55-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H16OS
InChI InChI=1S/C16H16OS/c1-13(18-15-10-6-3-7-11-15)16(17)12-14-8-4-2-5-9-14/h2-11,13H,12H2,1H3
InChIKey KVDIHESSODUOSD-UHFFFAOYSA-N
Molecular Weight 256.363 g/mol
SMILES C(C(Sc1ccccc1)C)(Cc1ccccc1)=O
SPLASH splash10-052u-3920000000-67f55d6abbb1d5bb5cd6
Source of Spectrum KC-1986-1944-16
Synonyms 1-Phenyl-3-(phenylsulfanyl)-2-butanone 1-Phenyl-3-phenylthio-2-butanone 1-Phenyl-3-phenylthiobutan-2-one
Wiley ID 1260004