| SpectraBase Spectrum ID |
74E79BcqXwX |
| Name |
17.ALPHA.-ETHYNYL-ESTR-4-ENE-17.BETA.-OL-3-ONE(3-O-METHYLOXIME) |
| Copyright |
Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
327.219829176 u |
| Formula |
C21H29NO2 |
| InChI |
InChI=1S/C21H29NO2/c1-4-21(23)12-10-19-18-7-5-14-13-15(22-24-3)6-8-16(14)17(18)9-11-20(19,21)2/h1,13,16-19,23H,5-12H2,2-3H3/b22-15+/t16-,17+,18+,19-,20-,21-/m0/s1 |
| InChIKey |
LCSBNAMHSCHNAR-VTKCIJPMSA-N |
| Molecular Weight |
327.468 g/mol |
| Nominal Mass |
327 u |
| Number of Peaks |
187 |
| SMILES |
O[C@]1(CC[C@]2([C@@]3(CCC4=C\C(CC[C@@]4([C@]3(CC[C@]12C)[H])[H])=N\OC)[H])[H])C#C |
| SPLASH |
splash10-004i-7986000000-0a85f92a42f43c7f71a2 |
| Source File Reference |
LMCM-76517-716G |
| Source of Spectrum |
Dr. Makin, London Hospital Medical College, UK |
| Synonyms |
17-ETHYNYL-17-HYDROXYESTR-4-EN-3-ONE O-METHYLOXIME
(1R,3aS,3bR,9aR,9bS,11aS,E)-17-ethynyl-17-hydroxy-13-methyl-6,7,8,9,10,11,12,13,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3(2H)-one O-methyl oxime |
| Wiley ID |
4_1400 |
