For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
1-Propanone, 1-[1-(phenylthio)cyclohexyl]-
SpectraBase Compound ID 4xrPP3IyxFq
InChI InChI=1S/C15H20OS/c1-2-14(16)15(11-7-4-8-12-15)17-13-9-5-3-6-10-13/h3,5-6,9-10H,2,4,7-8,11-12H2,1H3
InChIKey VSJJQQJAKSJRGJ-UHFFFAOYSA-N
Mol Weight 248.38 g/mol
Molecular Formula C15H20OS
Exact Mass 248.123486 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 2iHicvXIl9R
Name 1-Propanone, 1-[1-(phenylthio)cyclohexyl]-
CAS Registry Number 71221-53-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H20OS
InChI InChI=1S/C15H20OS/c1-2-14(16)15(11-7-4-8-12-15)17-13-9-5-3-6-10-13/h3,5-6,9-10H,2,4,7-8,11-12H2,1H3
InChIKey VSJJQQJAKSJRGJ-UHFFFAOYSA-N
Molecular Weight 248.384 g/mol
SMILES C1(Sc2ccccc2)(C(=O)CC)CCCCC1
SPLASH splash10-0a4j-9070000000-63ca735a48590eb51d6f
Source of Spectrum KC-1979-1087-0
Synonyms 1-(1-(Phenylthio)cyclohexyl)propanone 1-[1-(phenylsulfanyl)cyclohexyl]-1-propanone
Wiley ID 1251222