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

*Links on SpectraBase are not permalinks.
3-[(E)-3-(Phenylthio)-2-methyl-1-propenyl]cyclohexanone
SpectraBase Compound ID FpUHFS2BMxm
InChI InChI=1S/C16H20OS/c1-13(10-14-6-5-7-15(17)11-14)12-18-16-8-3-2-4-9-16/h2-4,8-10,14H,5-7,11-12H2,1H3/b13-10+
InChIKey JIERNXUNZKSWPX-JLHYYAGUSA-N
Mol Weight 260.39 g/mol
Molecular Formula C16H20OS
Exact Mass 260.123486 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 KC4t4BQDCFY
Name 3-[(E)-3-(Phenylthio)-2-methyl-1-propenyl]cyclohexanone
Alternate Name(s) 3-[(1E)-2-methyl-3-(phenylsulfanyl)-1-propenyl]cyclohexanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H20OS
InChI InChI=1S/C16H20OS/c1-13(10-14-6-5-7-15(17)11-14)12-18-16-8-3-2-4-9-16/h2-4,8-10,14H,5-7,11-12H2,1H3/b13-10+
InChIKey JIERNXUNZKSWPX-JLHYYAGUSA-N
Molecular Weight 260.395 g/mol
SMILES C(\C(=C\C1CC(=O)CCC1)C)Sc1ccccc1
SPLASH splash10-08fr-9510000000-672cbf908dfdd76d6dfd
Source of Spectrum J-57-3184-16
Wiley ID 1263972