| SpectraBase Spectrum ID |
EKAamvRQKfJ |
| Name |
1-Octen-3-one, 1-[6-(acetyloxy)octahydro-1-pentalenyl]-, [1.alpha.(E),3a.alpha.,6.beta.,6a.alpha.]-(.+-.)- |
| Alternate Name(s) |
(1R,3aS,6S,6aR)-6-[(1E)-3-oxo-1-octenyl]octahydro-1-pentalenyl acetate
4.beta.-(3'-octenyl)bicyclo[3.3.0]octan-6.alpha.-yl acetate |
| CAS Registry Number |
127268-89-7 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H28O3 |
| InChI |
InChI=1S/C18H28O3/c1-3-4-5-6-16(20)11-9-14-7-8-15-10-12-17(18(14)15)21-13(2)19/h9,11,14-15,17-18H,3-8,10,12H2,1-2H3/b11-9+/t14-,15-,17+,18-/m0/s1 |
| InChIKey |
IZQLDRTYIPPNTO-DXIYPJQGSA-N |
| Molecular Weight |
292.419 g/mol |
| SMILES |
[C@]1([C@]2([C@](\C=C\C(=O)CCCCC)(CC[C@@]2([H])CC1)[H])[H])(OC(=O)C)[H] |
| SPLASH |
splash10-0006-9000000000-8bf6197d0a8957b06cda |
| Source of Spectrum |
F-45-5665-43 |
| Wiley ID |
1295729 |
![1-Octen-3-one, 1-[6-(acetyloxy)octahydro-1-pentalenyl]-, [1.alpha.(E),3a.alpha.,6.beta.,6a.alpha.]-(.+-.)-](/api/spectrum/EKAamvRQKfJ/structure.png?h=300&w=458 "1-Octen-3-one, 1-[6-(acetyloxy)octahydro-1-pentalenyl]-, [1.alpha.(E),3a.alpha.,6.beta.,6a.alpha.]-(.+-.)-")
