SpectraBase Spectrum ID |
CKkb7bwjihC |
Name |
r-1-Phenyl-1-fluoro-c-2-chloro-c-4-tert-butylcylohexane |
CAS Registry Number |
87830-05-5 |
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+/m1/s1 |
InChIKey |
FYXSEMUKCFGGQA-XIFZVWCKSA-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-9510000000-0e37c40b3a67759a43cb |
Source of Spectrum |
J-49-336-0 |
Synonyms |
[(1S,4R)-4-tert-butyl-2-chloro-1-fluorocyclohexyl]benzene |
Wiley ID |
1272389 |