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5.ALPHA.-ANDROST-2-ENE-1,17-DIONE(17-O-METHYLOXIME)
SpectraBase Compound ID ANcXrwcgKGU
InChI InChI=1S/C20H29NO2/c1-19-12-11-16-14(15(19)9-10-17(19)21-23-3)8-7-13-5-4-6-18(22)20(13,16)2/h4,6,13-16H,5,7-12H2,1-3H3/b21-17+/t13-,14+,15+,16+,19+,20+/m1/s1
InChIKey QCZGVCOXBJTOOC-JRTSKMMSSA-N
Mol Weight 315.46 g/mol
Molecular Formula C20H29NO2
Exact Mass 315.219829 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GVXnhvODazQ
Name 5.ALPHA.-ANDROST-2-ENE-1,17-DIONE-17-(O-METHYLOXIME)
Copyright Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 315.219829176 u
Formula C20H29NO2
InChI InChI=1S/C20H29NO2/c1-19-12-11-16-14(15(19)9-10-17(19)21-23-3)8-7-13-5-4-6-18(22)20(13,16)2/h4,6,13-16H,5,7-12H2,1-3H3/b21-17+/t13-,14+,15+,16+,19+,20+/m1/s1
InChIKey QCZGVCOXBJTOOC-JRTSKMMSSA-N
Molecular Weight 315.457 g/mol
Nominal Mass 315 u
Number of Peaks 40
SMILES C1=CC([C@@]2([C@]3(CC[C@@]4(\C(CC[C@]4([C@@]3(CC[C@]2(C1)[H])[H])[H])=N\OC)C)[H])C)=O
SPLASH splash10-001i-2090000000-e3277be8f164ef128c96
Source File Reference LMCM-92023-440Q
Source of Spectrum Dr. Makin, London Hospital Medical College, UK
Synonyms ANDROST-2-ENE-1,17-DIONE 17-(O-METHYLOXIME) (5S,8S,9S,10S,13S,14S,E)-17-(methoxyimino)-10,13-dimethyl-4,5,6,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-1-one
Wiley ID 4_1681