| SpectraBase Spectrum ID |
2mu7H96QbDM |
| Name |
Alfatradiol |
| Classification |
Pharmaceutical drug, anti-androgenetic alopecia |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
272.177630011 u |
| Formula |
C18H24O2 |
| InChI |
InChI=1S/C18H24O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h3,5,10,14-17,19-20H,2,4,6-9H2,1H3/t14-,15-,16+,17-,18+/m1/s1 |
| InChIKey |
VOXZDWNPVJITMN-SFFUCWETSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
272.388 g/mol |
| Nominal Mass |
272 u |
| Quality |
995 |
| Retention Index |
2667 |
| SMILES |
O[C@]1([C@@]2([C@]([C@]3([C@@](C=4C(=CC(=CC4)O)CC3)(CC2)[H])[H])(CC1)[H])C)[H] |
| SPLASH |
splash10-00di-2940000000-2567dea638074196367f |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Epiestradiol
alpha-Estradiol
(8R,9S,13S,14S,17R)-13-Methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]-\rphenanthrene-3,17-diol |
| Technique |
GC/MS |
| Wiley ID |
DD2024_012056 |
