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1-cyclohexyl-3-(phenylsulfanyl)-1-propanone
SpectraBase Compound ID EUJw60iWSx2
InChI InChI=1S/C15H20OS/c16-15(13-7-3-1-4-8-13)11-12-17-14-9-5-2-6-10-14/h2,5-6,9-10,13H,1,3-4,7-8,11-12H2
InChIKey NOMXENIGOSOAOD-UHFFFAOYSA-N
Mol Weight 248.38 g/mol
Molecular Formula C15H20OS
Exact Mass 248.123486 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BGzuVk7JMOM
Name 1-cyclohexyl-3-(phenylsulfanyl)-1-propanone
CAS Registry Number 70910-88-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H20OS
InChI InChI=1S/C15H20OS/c16-15(13-7-3-1-4-8-13)11-12-17-14-9-5-2-6-10-14/h2,5-6,9-10,13H,1,3-4,7-8,11-12H2
InChIKey NOMXENIGOSOAOD-UHFFFAOYSA-N
Molecular Weight 248.384 g/mol
SMILES C(=O)(C1CCCCC1)CCSc1ccccc1
SPLASH splash10-008a-5950000000-52655a48f7905ebd057a
Source of Spectrum AJ-60-308-31
Synonyms 1-cyclohexyl-3-(phenylthio)-1-propanone 1-cyclohexyl-3-(phenylthio)propan-1-one 1-cyclohexyl-3-phenylsulfanyl-propan-1-one
Wiley ID 1251235