SpectraBase Spectrum ID |
2pU0p5BBfzU |
Name |
17alpha-Hydroxy-5-alpha-androstan-3-one |
Classification |
Pharmaceutical drug intermediate |
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/h12,14-17,21H,3-11H2,1-2H3/t12-,14-,15-,16-,17+,18-,19-/m0/s1 |
InChIKey |
NVKAWKQGWWIWPM-OPAYZWDASA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
290.447 g/mol |
Nominal Mass |
290 u |
Quality |
992 |
Retention Index |
2360 |
SMILES |
O[C@]1([C@@]2([C@]([C@]3([C@@]([C@@]4([C@@](CC3)(CC(CC4)=O)[H])C)(CC2)[H])[H])(CC1)[H])C)[H] |
SPLASH |
splash10-000x-8970000000-f141992f0237903298e8 |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
17alpha-Hydroxy-5alpha-androstan-3-one
(1R,3aS,3bR,5aS,9aS,9bS,11aS)-1-hydroxy-9a,11a-dimethylhexadecahydro-7H-cyclopenta[a]phenanthren-7-one |
Technique |
GC/MS |
Wiley ID |
DD2024_011558 |