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17-Hydroxyandrostan-3-one
SpectraBase Compound ID Bl4FZTi5C3A
InChI InChI=1S/C19H30O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h12,14-17,21H,3-11H2,1-2H3/t12-,14-,15-,16-,17+,18-,19-/m0/s1
InChIKey NVKAWKQGWWIWPM-OPAYZWDASA-N
Mol Weight 290.45 g/mol
Molecular Formula C19H30O2
Exact Mass 290.22458 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2pU0p5BBfzU
Name 17alpha-Hydroxy-5-alpha-androstan-3-one
Classification Pharmaceutical drug intermediate
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 290.224580204 u
Formula C19H30O2
InChI InChI=1S/C19H30O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h12,14-17,21H,3-11H2,1-2H3/t12-,14-,15-,16-,17+,18-,19-/m0/s1
InChIKey NVKAWKQGWWIWPM-OPAYZWDASA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 290.447 g/mol
Nominal Mass 290 u
Quality 992
Retention Index 2360
SMILES O[C@]1([C@@]2([C@]([C@]3([C@@]([C@@]4([C@@](CC3)(CC(CC4)=O)[H])C)(CC2)[H])[H])(CC1)[H])C)[H]
SPLASH splash10-000x-8970000000-f141992f0237903298e8
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 17alpha-Hydroxy-5alpha-androstan-3-one (1R,3aS,3bR,5aS,9aS,9bS,11aS)-1-hydroxy-9a,11a-dimethylhexadecahydro-7H-cyclopenta[a]phenanthren-7-one
Technique GC/MS
Wiley ID DD2024_011558