| SpectraBase Spectrum ID |
D2VPZVYPBZ7 |
| Name |
3aH-Indol-3a-ol, 2,3,4,5,6,7-hexahydro-2,2-dimethyl-7-(phenylmethyl)-, benzoate (ester) |
| CAS Registry Number |
90595-96-3 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C24H25NO2 |
| InChI |
InChI=1S/C24H25NO2/c1-23(2)17-24(27-22(26)19-12-7-4-8-13-19)15-9-14-20(21(24)25-23)16-18-10-5-3-6-11-18/h3-8,10-13,16H,9,14-15,17H2,1-2H3/b20-16+ |
| InChIKey |
CMSQFCCOQWSLLG-CAPFRKAQSA-N |
| Molecular Weight |
359.469 g/mol |
| SMILES |
C12(C(=NC(C2)(C)C)\C(=C\c2ccccc2)CCC1)OC(=O)c1ccccc1 |
| SPLASH |
splash10-052r-0193000000-a13fb10a9b96c61bb93e |
| Source of Spectrum |
B-37-583-0 |
| Synonyms |
(7E)-7-benzylidene-2,2-dimethyl-2,3,4,5,6,7-hexahydro-3aH-indol-3a-yl benzoate
7-Benzylidene-2,2-dimethyl-3,3a,4,5,6,7-hexahydro-2H-indol-3a-yl benzoate |
| Wiley ID |
1347904 |
