| SpectraBase Spectrum ID |
DkyoKj8CPPE |
| Name |
Cholesterol |
| CAS Registry Number |
57-88-5 |
| Classification |
Pharmaceutical drug, excipient |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
386.354866100 u |
| Formula |
C27H46O |
| InChI |
InChI=1S/C27H46O/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-20-17-21(28)13-15-26(20,4)25(22)14-16-27(23,24)5/h9,18-19,21-25,28H,6-8,10-17H2,1-5H3/t19?,21-,22-,23+,24-,25?,26-,27+/m0/s1 |
| InChIKey |
HVYWMOMLDIMFJA-XYKSZJKPSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
386.664 g/mol |
| Nominal Mass |
386 u |
| Quality |
964 |
| Retention Index |
3086 |
| SMILES |
O[C@@]1(CC=2[C@@](C3[C@]([C@]4([C@@]([C@](CC4)(C(CCCC(C)C)C)[H])(CC3)C)[H])(CC2)[H])(CC1)C)[H] |
| SPLASH |
splash10-0a4u-6935000000-b33881dbebf77d37c73b |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Cholesterine
(3S,8S,9S,10R,13R,14S,17R)-10,13-Dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,- \r12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol |
| Technique |
GC/MS |
| Wiley ID |
DD2024_000701 |
