| SpectraBase Spectrum ID |
8JlAGyif5Wq |
| Name |
Medroxyprogesterone acetate |
| CAS Registry Number |
71-58-9 |
| Classification |
Contraceptive |
| Copyright |
Copyright © 2024-2025 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
386.245709571 u |
| Formula |
C24H34O4 |
| InChI |
InChI=1S/C24H34O4/c1-14-12-18-19(22(4)9-6-17(27)13-21(14)22)7-10-23(5)20(18)8-11-24(23,15(2)25)28-16(3)26/h13-14,18-20H,6-12H2,1-5H3/t14-,18+,19-,20-,22+,23-,24-/m0/s1 |
| InChIKey |
PSGAAPLEWMOORI-PEINSRQWSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
386.532 g/mol |
| Nominal Mass |
386 u |
| Quality |
966 |
| Retention Index |
3004 |
| SMILES |
[C@]12([C@]3([C@@]([C@@]4(C([C@](C3)(C)[H])=CC(CC4)=O)C)(CC[C@@]2([C@](CC1)(C(=O)C)OC(=O)C)C)[H])[H])[H] |
| SPLASH |
splash10-0006-9310000000-a554b75460639ce042f9 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
[(6S,8R,9S,10R,13S,14S,17R)-17-Acetyl-6,10,13-trimethyl-3-oxo-2,6,7,8,9,11,12,14,15,16-\rdecahydro-1H-cyclopenta[a]phenanthren-17-yl] acetate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_012845 |
