| SpectraBase Spectrum ID |
3Zk9EKAEdEn |
| Name |
(1'S,6'S,E)-4-(2',2',6'-Trimethylcyclohexyl)but-3-en-2-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H22O |
| InChI |
InChI=1S/C13H22O/c1-10-6-5-9-13(3,4)12(10)8-7-11(2)14/h7-8,10,12H,5-6,9H2,1-4H3/b8-7+/t10-,12+/m0/s1 |
| InChIKey |
YJRODKCOICMRBO-PXYQHZOESA-N |
| Molecular Weight |
194.318 g/mol |
| SMILES |
[C@]1(\C=C\C(=O)C)(C(CCC[C@@]1(C)[H])(C)C)[H] |
| SPLASH |
splash10-0a4m-9400000000-6003b46c31bf9cbb27e4 |
| Source of Spectrum |
H-76-2085-21 |
| Synonyms |
(3E)-4-[(1S,6S)-2,2,6-trimethylcyclohexyl]-3-buten-2-one |
| Wiley ID |
1191527 |
