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1-Phenyl-4-(phenylmethylsulfanyl)butan-1-one

View entire compound with spectra: 1 MS (GC)

1-Phenyl-4-(phenylmethylsulfanyl)butan-1-one
SpectraBase Compound ID CyRXnakmEgh
InChI InChI=1S/C17H18OS/c18-17(16-10-5-2-6-11-16)12-7-13-19-14-15-8-3-1-4-9-15/h1-6,8-11H,7,12-14H2
InChIKey TWENXAGHLQXDEK-UHFFFAOYSA-N
Mol Weight 270.39 g/mol
Molecular Formula C17H18OS
Exact Mass 270.107836 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1HeyaZ9Pwe
Name 1-Phenyl-4-(phenylmethylsulfanyl)butan-1-one
CAS Registry Number 133578-18-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H18OS
InChI InChI=1S/C17H18OS/c18-17(16-10-5-2-6-11-16)12-7-13-19-14-15-8-3-1-4-9-15/h1-6,8-11H,7,12-14H2
InChIKey TWENXAGHLQXDEK-UHFFFAOYSA-N
Molecular Weight 270.390 g/mol
SMILES C(=O)(c1ccccc1)CCCSCc1ccccc1
SPLASH splash10-0ufu-7900000000-f1ddfd8c936feaed7d3b
Source of Spectrum J-56-3830-33
Synonyms 1-Phenyl-4-(phenylmethylthio)-1-butanone 4-(benzylthio)-1-phenyl-butan-1-one 4-Benzylsulfanyl-1-phenyl-butan-1-one
Wiley ID 1274543