| SpectraBase Spectrum ID |
JFy8s8REbya |
| Name |
Cholesteryl trimethyl acetate |
| Classification |
Pharmaceutical excipient derivative |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
470.412380977 u |
| Formula |
C32H54O2 |
| InChI |
InChI=1S/C32H54O2/c1-21(2)10-9-11-22(3)26-14-15-27-25-13-12-23-20-24(34-29(33)30(4,5)6)16-18-31(23,7)28(25)17-19-32(26,27)8/h12,21-22,24-28H,9-11,13-20H2,1-8H3/t22?,24-,25-,26+,27-,28?,31-,32+/m0/s1 |
| InChIKey |
MVPULBXRVIPBET-WZFYCZTKSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
470.782 g/mol |
| Nominal Mass |
470 u |
| Quality |
816 |
| Retention Index |
3399 |
| SMILES |
[C@@]12([C@]3([C@@]([C@](CC3)(C(CCCC(C)C)C)[H])(CCC1[C@@]1(C(=CC2)C[C@](CC1)(OC(C(C)(C)C)=O)[H])C)C)[H])[H] |
| SPLASH |
splash10-066r-9738000000-a87e04d28f93dcae23ff |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
(1R,3aS,3bS,7S,9aR,11aR)-9a,11a-dimethyl-1-((2S)-6-methylheptan-2-yl)-2,3,3a,3b,4,6,7,8,9,9a\r,9b,10,11,11a-tetradecahydro-1H-cyclopenta[a]phenanthren-7-yl 2,2-dimethylpropanoate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_010252 |
