| SpectraBase Spectrum ID |
JIuCUVo9naC |
| Name |
Cyproterone acetate |
| Classification |
Pharmaceutical drug, antiandrogene |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
416.175437110 u |
| Formula |
C24H29ClO4 |
| InChI |
InChI=1S/C24H29ClO4/c1-12(26)24(29-13(2)27)8-6-16-14-10-20(25)19-11-21(28)15-9-18(15)23(19,4)17(14)5-7-22(16,24)3/h10-11,14-18H,5-9H2,1-4H3/t14-,15+,16-,17-,18-,22-,23-,24-/m0/s1 |
| InChIKey |
UWFYSQMTEOIJJG-FDTZYFLXSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
416.945 g/mol |
| Nominal Mass |
416 u |
| Quality |
858 |
| Retention Index |
3301 |
| SMILES |
[C@@]12([C@@]([C@]3([C@@]4([C@@](C4)(C(C=C3C(=C1)Cl)=O)[H])[H])C)(CC[C@]1([C@]2(CC[C@@]1(C(=O)C)OC(=O)C)[H])C)[H])[H] |
| SPLASH |
splash10-01ox-9237000000-3309e50652f2e7a96221 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
6-Chloro-1alpha,2alpha-methylene-4,6-pregnadiene-3,20-dione-17-yl acetate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_010288 |
