SpectraBase Spectrum ID |
9sndfNjkNC6 |
Name |
(3S,4S)-3,4-dimethyl-1-cyclohexanone |
CAS Registry Number |
28023-45-2 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C8H14O |
InChI |
InChI=1S/C8H14O/c1-6-3-4-8(9)5-7(6)2/h6-7H,3-5H2,1-2H3/t6-,7-/m0/s1 |
InChIKey |
ZDCYWXYPRPCJOY-BQBZGAKWSA-N |
Molecular Weight |
126.199 g/mol |
SMILES |
[C@]1(CC(=O)CC[C@@]1(C)[H])(C)[H] |
SPLASH |
splash10-014i-9200000000-637847d1557e570948bb |
Source of Spectrum |
K-118-2441-5 |
Synonyms |
(3S,4S)-3,4-dimethylcyclohexan-1-one
(3S,4S)-3,4-dimethylcyclohexanone
trans-3,4-Dimethylcyclohexanone |
Wiley ID |
1130277 |