| SpectraBase Spectrum ID |
8oMESOAnZ3f |
| Name |
8S,9S-7.beta.,11,12-Triacetoxydrimane isomer |
| Alternate Name(s) |
Acetic acid (2S,3S,4S,4aS)-3,4-bis-acetoxymethyl-4a,8,8-trimethyl-decahydro-naphthalen-2-yl ester
{(1S,2S,3S,4aS,8aS)-3-(acetyloxy)-1-[(acetyloxy)methyl]-5,5,8a-trimethyldecahydro-2-naphthalenyl}methyl acetate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H34O6 |
| InChI |
InChI=1S/C21H34O6/c1-13(22)25-11-16-17(12-26-14(2)23)21(6)9-7-8-20(4,5)19(21)10-18(16)27-15(3)24/h16-19H,7-12H2,1-6H3/t16-,17+,18+,19?,21-/m1/s1 |
| InChIKey |
HPRGSAMQBXMUAF-JITNJQOXSA-N |
| Molecular Weight |
382.497 g/mol |
| SMILES |
[C@]12(C(C[C@@]([C@@]([C@@]2(COC(=O)C)[H])(COC(=O)C)[H])(OC(=O)C)[H])C(C)(C)CCC1)C |
| SPLASH |
splash10-0ac9-9750000000-146ecb5a16cebd9acc32 |
| Source of Spectrum |
F-51-1854-16 |
| Wiley ID |
790882 |
