SpectraBase Spectrum ID |
DRDlO6l3jau |
Name |
Cyclohexanone, 2-chloro-4-hydroxy-2,6,6-trimethyl-, (2R-trans)- |
CAS Registry Number |
80713-50-4 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C9H15ClO2 |
InChI |
InChI=1S/C9H15ClO2/c1-8(2)4-6(11)5-9(3,10)7(8)12/h6,11H,4-5H2,1-3H3/t6-,9+/m0/s1 |
InChIKey |
CPPNVAVUXAALJZ-IMTBSYHQSA-N |
Molecular Weight |
190.670 g/mol |
SMILES |
O[C@]1(CC(C([C@@](C1)(Cl)C)=O)(C)C)[H] |
SPLASH |
splash10-0079-9000000000-6c4e08694e8679d55fd1 |
Source of Spectrum |
H-64-2414-0 |
Synonyms |
(2R,4S)-2-chloro-4-hydroxy-2,6,6-trimethylcyclohexanone |
Wiley ID |
1186295 |