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

*Links on SpectraBase are not permalinks.
r-1-Phenyl-1-fluoro-c-2-chloro-t-4-tert-butylcylohexane
SpectraBase Compound ID CFEvGcLhjxb
InChI InChI=1S/C16H22ClF/c1-15(2,3)13-9-10-16(18,14(17)11-13)12-7-5-4-6-8-12/h4-8,13-14H,9-11H2,1-3H3/t13-,14?,16-/m0/s1
InChIKey FYXSEMUKCFGGQA-SFIRGFGWSA-N
Mol Weight 268.8 g/mol
Molecular Formula C16H22ClF
Exact Mass 268.139407 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 6cUFV07LqsS
Name r-1-Phenyl-1-fluoro-c-2-chloro-t-4-tert-butylcylohexane
CAS Registry Number 87830-03-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H22ClF
InChI InChI=1S/C16H22ClF/c1-15(2,3)13-9-10-16(18,14(17)11-13)12-7-5-4-6-8-12/h4-8,13-14H,9-11H2,1-3H3/t13-,14?,16-/m0/s1
InChIKey FYXSEMUKCFGGQA-SFIRGFGWSA-N
Molecular Weight 268.803 g/mol
SMILES [C@@]1(C(C[C@](CC1)(C(C)(C)C)[H])Cl)(c1ccccc1)F
SPLASH splash10-0a4i-9610000000-f347774a9ddd2f1451c2
Source of Spectrum J-49-336-0
Synonyms [(1S,4S)-4-tert-butyl-2-chloro-1-fluorocyclohexyl]benzene
Wiley ID 1272388