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

*Links on SpectraBase are not permalinks.
Cyclohexanone, 2-[2-methyl-3-(phenylthio)-2-propenyl]-, (Z)-
SpectraBase Compound ID 8jVGujeOszq
InChI InChI=1S/C16H20OS/c1-13(11-14-7-5-6-10-16(14)17)12-18-15-8-3-2-4-9-15/h2-4,8-9,12,14H,5-7,10-11H2,1H3/b13-12-
InChIKey ZRIKHMUXZLOLKF-SEYXRHQNSA-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 8ucMFaP1VTx
Name Cyclohexanone, 2-[2-methyl-3-(phenylthio)-2-propenyl]-, (Z)-
Alternate Name(s) (Z)-2-(3-phenylthio-2-methyl-2-propenyl)cyclohexanone 2-[(2Z)-2-methyl-3-(phenylsulfanyl)-2-propenyl]cyclohexanone
CAS Registry Number 125417-54-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H20OS
InChI InChI=1S/C16H20OS/c1-13(11-14-7-5-6-10-16(14)17)12-18-15-8-3-2-4-9-15/h2-4,8-9,12,14H,5-7,10-11H2,1H3/b13-12-
InChIKey ZRIKHMUXZLOLKF-SEYXRHQNSA-N
Molecular Weight 260.395 g/mol
SMILES C1(C(C\C(=C/Sc2ccccc2)C)CCCC1)=O
SPLASH splash10-0w2i-0920000000-009941b3418e7a62ffa6
Source of Spectrum KC-1989-1636-8
Wiley ID 1263967