| SpectraBase Spectrum ID |
2nyTgWpMSKu |
| Name |
6-Hydroxyandrost-4-ene-3,17-dione |
| Classification |
Pharmaceutical drug derivative |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
302.188194694 u |
| Formula |
C19H26O3 |
| InChI |
InChI=1S/C19H26O3/c1-18-7-5-11(20)9-15(18)16(21)10-12-13-3-4-17(22)19(13,2)8-6-14(12)18/h9,12-14,16,21H,3-8,10H2,1-2H3/t12-,13-,14-,16?,18+,19-/m0/s1 |
| InChIKey |
WVAMBAWFDOYFOD-WFJVDCJUSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
302.414 g/mol |
| Nominal Mass |
302 u |
| Quality |
833 |
| Retention Index |
2407 |
| SMILES |
OC1C=2[C@@]([C@@]3([C@]([C@]4([C@@](C(CC4)=O)(CC3)C)[H])(C1)[H])[H])(CCC(C2)=O)C |
| SPLASH |
splash10-0udi-9873000000-8399fff248e92c25bb33 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Formestane
(3aS,3bR,9aR,9bS,11aS)-5-hydroxy-9a,11a-dimethyl-2,3,3a,4,5,8,9,9a,9b,10,11,11a-\rdodecahydro-1H-cyclopenta[a]phenanthrene-1,7(3bH)-dione |
| Technique |
GC/MS |
| Wiley ID |
DD2024_014472 |
