SpectraBase Spectrum ID |
8G4hsQItEZc |
Name |
Androsterone AC |
CAS Registry Number |
1482-78-6 |
Classification |
Pharmaceutical drug derivative |
Comments |
Spectrum verified by independent measurements in external laboratories |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
332.235144887 u |
Formula |
C21H32O3 |
InChI |
InChI=1S/C21H32O3/c1-13(22)24-15-8-10-20(2)14(12-15)4-5-16-17-6-7-19(23)21(17,3)11-9-18(16)20/h14-18H,4-12H2,1-3H3/t14-,15+,16-,17-,18-,20-,21-/m0/s1 |
InChIKey |
FDCINQSOYQUNKB-XVYLQWLCSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
332.484 g/mol |
Nominal Mass |
332 u |
Quality |
912 |
Retention Index |
2639 |
SMILES |
[C@]12([C@@]([C@@]3([C@@](CC2)(C[C@@](CC3)(OC(=O)C)[H])[H])C)(CC[C@]2([C@]1(CCC2=O)[H])C)[H])[H] |
SPLASH |
splash10-052f-9780000000-2cf8823de12812532bbd |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
[(3R,5S,8R,9S,14S)-10,13-Dimethyl-17-oxo-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydro-\rcyclopenta[a]-phenanthren-3-yl] acetate |
Technique |
GC/MS |
Wiley ID |
DD2024_012082 |