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Androst-5-en-17-one, 1-(acetyloxy)-3-hydroxy-, (1.alpha.,3.beta.)-
SpectraBase Compound ID 2ia3jiVYAWi
InChI InChI=1S/C21H30O4/c1-12(22)25-19-11-14(23)10-13-4-5-15-16-6-7-18(24)20(16,2)9-8-17(15)21(13,19)3/h4,14-17,19,23H,5-11H2,1-3H3/t14-,15+,16+,17+,19+,20+,21+/m1/s1
InChIKey SMWOHFSMSMYRDE-HAFCSRAXSA-N
Mol Weight 346.47 g/mol
Molecular Formula C21H30O4
Exact Mass 346.214409 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Lhrg5rDVah0
Name Androst-5-en-17-one, 1-(acetyloxy)-3-hydroxy-, (1.alpha.,3.beta.)-
CAS Registry Number 80239-58-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H30O4
InChI InChI=1S/C21H30O4/c1-12(22)25-19-11-14(23)10-13-4-5-15-16-6-7-18(24)20(16,2)9-8-17(15)21(13,19)3/h4,14-17,19,23H,5-11H2,1-3H3/t14-,15+,16+,17+,19+,20+,21+/m1/s1
InChIKey SMWOHFSMSMYRDE-HAFCSRAXSA-N
Molecular Weight 346.467 g/mol
SMILES O[C@]1(C[C@@]([C@]2(C(=CC[C@@]3([C@@]2(CC[C@@]2(C(=O)CC[C@@]32[H])C)[H])[H])C1)C)(OC(=O)C)[H])[H]
SPLASH splash10-000l-2090000000-7432c222699124117432
Source of Spectrum H-64-1890-0
Synonyms (1alpha,3beta)-3-hydroxy-17-oxoandrost-5-en-1-yl acetate 1.alpha.-acetoxy-3.beta.-hydroxy-5-androsten-17-one
Wiley ID 1339482