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

*Links on SpectraBase are not permalinks.
2-(3,3,3-trifluoro-1-propylsulfanylpropyl)cyclohexan-1-one
SpectraBase Compound ID 2dnCAgXdwZE
InChI InChI=1S/C12H19F3OS/c1-2-7-17-11(8-12(13,14)15)9-5-3-4-6-10(9)16/h9,11H,2-8H2,1H3
InChIKey MWIJBMNUAVTJDQ-UHFFFAOYSA-N
Mol Weight 268.34 g/mol
Molecular Formula C12H19F3OS
Exact Mass 268.110871 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 4l4j5pJTLfA
Name 2-(3,3,3-trifluoro-1-propylsulfanylpropyl)cyclohexan-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H19F3OS
InChI InChI=1S/C12H19F3OS/c1-2-7-17-11(8-12(13,14)15)9-5-3-4-6-10(9)16/h9,11H,2-8H2,1H3
InChIKey MWIJBMNUAVTJDQ-UHFFFAOYSA-N
Molecular Weight 268.338 g/mol
SMILES C(CC(C1C(=O)CCCC1)SCCC)(F)(F)F
SPLASH splash10-0006-9510000000-2f42fdb8427c65d171b4
Source of Spectrum KC-0-281-9
Synonyms 2-[3,3,3-trifluoro-1-(propylthio)propyl]-1-cyclohexanone 2-[3,3,3-trifluoro-1-(propylthio)propyl]cyclohexanone 2-[3,3,3-tris(fluoranyl)-1-propylsulfanyl-propyl]cyclohexan-1-one
Wiley ID 824280