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1-Phenyl-4-(phenylthio)-1-butanone
SpectraBase Compound ID 4CA5febQJJW
InChI InChI=1S/C16H16OS/c17-16(14-8-3-1-4-9-14)12-7-13-18-15-10-5-2-6-11-15/h1-6,8-11H,7,12-13H2
InChIKey DVPURJJSFFNICF-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 Z2NfF7205h
Name 1-Phenyl-4-(phenylthio)-1-butanone
Alternate Name(s) 1-Phenyl-4-(phenylthio)butan-1-one 1-Phenyl-4-phenylsulfanyl-butan-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H16OS
InChI InChI=1S/C16H16OS/c17-16(14-8-3-1-4-9-14)12-7-13-18-15-10-5-2-6-11-15/h1-6,8-11H,7,12-13H2
InChIKey DVPURJJSFFNICF-UHFFFAOYSA-N
Molecular Weight 256.363 g/mol
SMILES C(=O)(c1ccccc1)CCCSc1ccccc1
SPLASH splash10-0551-4900000000-786b1f44d7fe1dd7e470
Source of Spectrum F-48-2038-24
Wiley ID 1260023