| SpectraBase Spectrum ID |
kfVbDOnA8A |
| Name |
3-beta-Etiocholanolone |
| Classification |
Pharmaceutical drug, immunostimulant |
| Comments |
Spectrum verified by independent measurements in external laboratories |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
290.224580204 u |
| Formula |
C19H30O2 |
| InChI |
InChI=1S/C19H30O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h12-16,20H,3-11H2,1-2H3/t12-,13+,14+,15+,16+,18+,19+/m1/s1 |
| InChIKey |
QGXBDMJGAMFCBF-XRJZGPCZSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
290.447 g/mol |
| Nominal Mass |
290 u |
| Quality |
916 |
| Retention Index |
2360 |
| SMILES |
O[C@@]1(C[C@@]2([C@@]([C@@]3([C@]([C@]4([C@@](C(CC4)=O)(CC3)C)[H])(CC2)[H])[H])(CC1)C)[H])[H] |
| SPLASH |
splash10-0006-7960000000-480bf459cd77deca4560 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
3beta-Aetiocholanolone
3beta-Hydroxy-5beta-androstan-17-one |
| Technique |
GC/MS |
| Wiley ID |
DD2024_004365 |
