SpectraBase Spectrum ID |
2OB10QswwU1 |
Name |
ESTRA-1,3,5(10)-TRIENE-3-OL-17-ONE-17-(O-METHYLOXIME) |
Copyright |
Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
299.188529047 u |
Formula |
C19H25NO2 |
InChI |
InChI=1S/C19H25NO2/c1-19-10-9-15-14-6-4-13(21)11-12(14)3-5-16(15)17(19)7-8-18(19)20-22-2/h4,6,11,15-17,21H,3,5,7-10H2,1-2H3/b20-18+/t15-,16-,17+,19+/m1/s1 |
InChIKey |
PBXZSAMJKKLMEF-YDKWXADCSA-N |
Molecular Weight |
299.414 g/mol |
Nominal Mass |
299 u |
Number of Peaks |
61 |
SMILES |
Oc1ccc2[C@]3(CC[C@@]4(\C(CC[C@]4([C@@]3(CCc2c1)[H])[H])=N\OC)C)[H] |
SPLASH |
splash10-014j-2390000000-9dec3c284e348fd039bd |
Source File Reference |
LMCM-41232-457N |
Source of Spectrum |
Dr. Makin, London Hospital Medical College, UK |
Synonyms |
3-HYDROXYESTRA-1(10),2,4-TRIEN-17-ONE O-METHYLOXIME
(3aS,3bR,9bS,11aS,E)-3-hydroxy-13-methyl-7,8,9,11,12,13,15,16-octahydro-6H-cyclopenta[a]phenanthren-17(14H)-one O-methyl oxime |
Wiley ID |
4_2091 |