| SpectraBase Spectrum ID |
2cJJf8CGb9r |
| Name |
(3aR,5aS,6S,8aR,8bS)-6-ethyl-3,3a,5a,6,7,8,8a,8b-octahydrocyclopenta[g]isobenzofuran-1-one |
| Alternate Name(s) |
(3aR,5aS,6S,8aR,8bS)-6-ethyl-3,3a,5a,6,7,8,8a,8b-octahydrocyclopenta[g][2]benzofuran-1-one
(3aR,5aS,6S,8aR,8bS)-6-ethyl-3,3a,5a,6,7,8,8a,8b-octahydrocyclopent[g]isobenzofuran-1-one |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H18O2 |
| InChI |
InChI=1S/C13H18O2/c1-2-8-3-6-11-10(8)5-4-9-7-15-13(14)12(9)11/h4-5,8-12H,2-3,6-7H2,1H3/t8-,9-,10+,11+,12+/m0/s1 |
| InChIKey |
OCOFCUSPESHPJB-PREPNJAASA-N |
| Molecular Weight |
206.285 g/mol |
| SMILES |
[C@@]12([C@](C=C[C@@]3([C@]2(C(OC3)=O)[H])[H])([C@@](CC)(CC1)[H])[H])[H] |
| SPLASH |
splash10-0002-9000000000-d3b4d0ca7ce241c622da |
| Source of Spectrum |
J-59-343-31 |
| Wiley ID |
1204827 |
![(3aR,5aS,6S,8aR,8bS)-6-ethyl-3,3a,5a,6,7,8,8a,8b-octahydrocyclopenta[g]isobenzofuran-1-one](/api/spectrum/2cJJf8CGb9r/structure.png?h=300&w=458 "(3aR,5aS,6S,8aR,8bS)-6-ethyl-3,3a,5a,6,7,8,8a,8b-octahydrocyclopenta[g]isobenzofuran-1-one")
