| SpectraBase Spectrum ID |
B9Ay3W2uA5B |
| Name |
3,3-Dimethyl-5a-phenyl-1,2,3,4,5a,6,7,8,9,9a-decahydro-6H-cyclohepta[b]benzofuran-1-one |
| Alternate Name(s) |
(5aS,10aS)-3,3-dimethyl-5a-phenyl-2,4,6,7,8,9,10,10a-octahydrocyclohepta[b][1]benzofuran-1-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H26O2 |
| InChI |
InChI=1S/C21H26O2/c1-20(2)13-17(22)19-16-11-7-4-8-12-21(16,23-18(19)14-20)15-9-5-3-6-10-15/h3,5-6,9-10,16H,4,7-8,11-14H2,1-2H3/t16-,21+/m0/s1 |
| InChIKey |
OKCGCTNEMYOEOL-HRAATJIYSA-N |
| Molecular Weight |
310.437 g/mol |
| SMILES |
C12=C(O[C@@]3([C@]2(CCCCC3)[H])c2ccccc2)CC(CC1=O)(C)C |
| SPLASH |
splash10-03xr-5229000000-44924bafe853a06b4693 |
| Source of Spectrum |
H1-54-178-3 |
| Wiley ID |
1564250 |
![3,3-Dimethyl-5a-phenyl-1,2,3,4,5a,6,7,8,9,9a-decahydro-6H-cyclohepta[b]benzofuran-1-one](/api/spectrum/B9Ay3W2uA5B/structure.png?h=300&w=458 "3,3-Dimethyl-5a-phenyl-1,2,3,4,5a,6,7,8,9,9a-decahydro-6H-cyclohepta[b]benzofuran-1-one")
