| SpectraBase Spectrum ID |
KCOCEjQ6dzC |
| Name |
Cyclohexanone, 4-(acetyloxy)-2,3,3-trimethyl-2-(3-oxo-1-butenyl)-, [2.alpha.(Z),4.alpha.]- |
| CAS Registry Number |
85197-98-4 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C15H22O4 |
| InChI |
InChI=1S/C15H22O4/c1-10(16)8-9-15(5)12(18)6-7-13(14(15,3)4)19-11(2)17/h8-9,13H,6-7H2,1-5H3/b9-8+/t13-,15+/m1/s1 |
| InChIKey |
WSLHTSJMZQWXGR-HOMMJUPQSA-N |
| Molecular Weight |
266.337 g/mol |
| SMILES |
[C@@]1(C([C@](OC(=O)C)(CCC1=O)[H])(C)C)(\C=C\C(=O)C)C |
| SPLASH |
splash10-0077-5910000000-c7a6e2e3efce0a55c542 |
| Source of Spectrum |
H-65-2370-0 |
| Synonyms |
(1'E,1R*,3R*)-[3-(3'-oxo-1'-butenyl)-2,2,3-trimethyl-4-oxocyclohexyl]acetate
(1'E,1R*,3R*,4S*)-[3-(3'-oxo-1'butenyl)-3,4-epoxy-2,2,4-trimethylcyclohexyl]acetate
(1R,3R)-2,2,3-trimethyl-4-oxo-3-[(1E)-3-oxo-1-butenyl]cyclohexyl acetate |
| Wiley ID |
1270037 |
![Cyclohexanone, 4-(acetyloxy)-2,3,3-trimethyl-2-(3-oxo-1-butenyl)-, [2.alpha.(Z),4.alpha.]-](/api/spectrum/KCOCEjQ6dzC/structure.png?h=300&w=458 "Cyclohexanone, 4-(acetyloxy)-2,3,3-trimethyl-2-(3-oxo-1-butenyl)-, [2.alpha.(Z),4.alpha.]-")
