| SpectraBase Spectrum ID |
1dtdS7Qj86e |
| Name |
2-Cyclohexen-1-one, 6-(acetyloxy)-3-(3-hydroxy-3-methyl-1,4-pentadienyl)-2,4,4-trimethyl- , [R*,S*-(E)]-(.+-.)- |
| CAS Registry Number |
80736-71-6 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H24O4 |
| InChI |
InChI=1S/C17H24O4/c1-7-17(6,20)9-8-13-11(2)15(19)14(21-12(3)18)10-16(13,4)5/h7-9,14,20H,1,10H2,2-6H3/b9-8+/t14-,17+/m0/s1 |
| InChIKey |
BQGIPVAFLWRYAR-JBRJIWJGSA-N |
| Molecular Weight |
292.375 g/mol |
| SMILES |
O[C@@](\C=C\C1=C(C(=O)[C@](CC1(C)C)(OC(=O)C)[H])C)(C=C)C |
| SPLASH |
splash10-059g-9660000000-91f0081c9c7888890940 |
| Source of Spectrum |
H-64-2429-0 |
| Synonyms |
(1S)-4-[(1E,3R)-3-hydroxy-3-methyl-1,4-pentadienyl]-3,5,5-trimethyl-2-oxo-3-cyclohexen-1-yl acetate
(3S)-[4-(3-hydroxy-3-methyl-1,4-pentadienyl)-3,5,5-trimethyl-2-oxo-3-cyclohexenyl]ester of acetic acid
[4-(3-hydroxy-3-methyl-1,4-pentadienyl)-3,5,5-trimethyl-2-oxo-3-cyclohexenyl]ester of acetic acid |
| Wiley ID |
1295537 |
![2-Cyclohexen-1-one, 6-(acetyloxy)-3-(3-hydroxy-3-methyl-1,4-pentadienyl)-2,4,4-trimethyl- , [R*,S*-(E)]-(.+-.)-](/api/spectrum/1dtdS7Qj86e/structure.png?h=300&w=458 "2-Cyclohexen-1-one, 6-(acetyloxy)-3-(3-hydroxy-3-methyl-1,4-pentadienyl)-2,4,4-trimethyl- , [R*,S*-(E)]-(.+-.)-")
