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Desoxycorticosterone
SpectraBase Compound ID HkMCzMAZhNk
InChI InChI=1S/C21H30O3/c1-20-9-7-14(23)11-13(20)3-4-15-16-5-6-18(19(24)12-22)21(16,2)10-8-17(15)20/h11,15-18,22H,3-10,12H2,1-2H3/t15-,16-,17-,18+,20-,21-/m0/s1
InChIKey ZESRJSPZRDMNHY-YFWFAHHUSA-N
Mol Weight 330.47 g/mol
Molecular Formula C21H30O3
Exact Mass 330.219495 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KHdscZ29hA8
Name 21-HYDROXY-PREGN-4-ENE-3,20-DIONE
Copyright Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 330.219494823 u
Formula C21H30O3
InChI InChI=1S/C21H30O3/c1-20-9-7-14(23)11-13(20)3-4-15-16-5-6-18(19(24)12-22)21(16,2)10-8-17(15)20/h11,15-18,22H,3-10,12H2,1-2H3/t15-,16-,17-,18+,20-,21-/m0/s1
InChIKey ZESRJSPZRDMNHY-YFWFAHHUSA-N
Molecular Weight 330.468 g/mol
Nominal Mass 330 u
Number of Peaks 91
SMILES OCC([C@]1(CC[C@]2([C@@]3(CCC4=CC(CC[C@@]4([C@]3(CC[C@]12C)[H])C)=O)[H])[H])[H])=O
SPLASH splash10-0002-7692000000-6a90b8544906462e23b1
Source File Reference LMCM-74632-627N
Source of Spectrum Prof. Spiteller, University Bayreuth, Germany
Synonyms 21-HYDROXYPREGN-4-ENE-3,20-DIONE (8S,9S,10R,13S,14S,17S)-17-(2-hydroxyacetyl)-10,13-dimethyl-6,7,8,9,10,11,12,13,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3(2H)-one
Wiley ID 4_322