| SpectraBase Spectrum ID |
8ZJREdyw0Kh |
| Name |
13-Acetoxy-13,14-seco-totaran-14R-ol |
| Alternate Name(s) |
3-{(1S,2R,8aR)-2-[(1R)-1-hydroxy-2-methylpropyl]-5,5,8a-trimethyldecahydro-1-naphthalenyl}propyl acetate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H40O3 |
| InChI |
InChI=1S/C22H40O3/c1-15(2)20(24)17-10-11-19-21(4,5)12-8-13-22(19,6)18(17)9-7-14-25-16(3)23/h15,17-20,24H,7-14H2,1-6H3/t17-,18+,19?,20-,22-/m1/s1 |
| InChIKey |
BRUFMLWUIXGNOJ-GUQWTYSISA-N |
| Molecular Weight |
352.559 g/mol |
| SMILES |
O[C@@]([C@]1([C@@]([C@@]2(C(CC1)C(C)(C)CCC2)C)(CCCOC(=O)C)[H])[H])(C(C)C)[H] |
| SPLASH |
splash10-060r-5690000000-6890b287148d9b5aae67 |
| Source of Spectrum |
KC-61-989-16 |
| Wiley ID |
1627324 |
