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3-(1-phenylsulfanylbutyl)cyclohexan-1-one

View entire compound with spectra: 1 MS (GC)

3-(1-phenylsulfanylbutyl)cyclohexan-1-one
SpectraBase Compound ID 8YFV1gG7DyG
InChI InChI=1S/C16H22OS/c1-2-7-16(13-8-6-9-14(17)12-13)18-15-10-4-3-5-11-15/h3-5,10-11,13,16H,2,6-9,12H2,1H3
InChIKey ABHHVRJPMVTKGK-UHFFFAOYSA-N
Mol Weight 262.41 g/mol
Molecular Formula C16H22OS
Exact Mass 262.139137 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FEsNs4G6WJP
Name 3-(1-phenylsulfanylbutyl)cyclohexan-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H22OS
InChI InChI=1S/C16H22OS/c1-2-7-16(13-8-6-9-14(17)12-13)18-15-10-4-3-5-11-15/h3-5,10-11,13,16H,2,6-9,12H2,1H3
InChIKey ABHHVRJPMVTKGK-UHFFFAOYSA-N
Molecular Weight 262.411 g/mol
SMILES C(Sc1ccccc1)(C1CC(=O)CCC1)CCC
SPLASH splash10-0cdl-9300000000-141511dbfc32038d1f55
Source of Spectrum F-48-2036-10
Synonyms 3-[1-(Phenylsulfanyl)butyl]cyclohexanone 3-[1-(phenylthio)butyl]-1-cyclohexanone 3-(1-Phenylsulfanylbutyl)cyclohexanone
Wiley ID 1266092