SpectraBase Spectrum ID |
Domlccy0YYy |
Name |
trans-Dehydroandrosterone ME |
Classification |
Pharmaceutical drug derivative |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
302.224580204 u |
Formula |
C20H30O2 |
InChI |
InChI=1S/C20H30O2/c1-19-10-8-14(22-3)12-13(19)4-5-15-16-6-7-18(21)20(16,2)11-9-17(15)19/h4,14-17H,5-12H2,1-3H3/t14-,15-,16-,17-,19-,20-/m0/s1 |
InChIKey |
FLCAHAJJOOEIKL-BGZMIMFDSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
302.458 g/mol |
Nominal Mass |
302 u |
Quality |
966 |
Retention Index |
2475 |
SMILES |
[C@]12([C@]([C@]3([C@@](C(CC3)=O)(CC1)C)[H])(CC=C1[C@@]2(CC[C@@](C1)(OC)[H])C)[H])[H] |
SPLASH |
splash10-0596-6950000000-35046cf4649f9f2e47de |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
(3aS,3bR,7S,9aR,9bS,11aS)-7-methoxy-9a,11a-dimethyl-2,3,3a,3b,4,6,7,8,9,9a,9b,10,\r11,11a-tetradecahydro-1H-cyclopenta[a]phenanthren-1-one |
Technique |
GC/MS |
Wiley ID |
DD2024_004395 |