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3a-hydroxy-1a-methyl-5a-androstan-17-one
SpectraBase Compound ID j1lvXquvFz
InChI InChI=1S/C20H32O2/c1-12-10-14(21)11-13-4-5-15-16-6-7-18(22)19(16,2)9-8-17(15)20(12,13)3/h12-17,21H,4-11H2,1-3H3/t12-,13-,14+,15-,16-,17-,19-,20-/m0/s1
InChIKey UBSQZFBBZMBPFF-XHSSWRBBSA-N
Mol Weight 304.5 g/mol
Molecular Formula C20H32O2
Exact Mass 304.24023 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5aiOs1Jh7CB
Name 3a-hydroxy-1a-methyl-5a-androstan-17-one
Alternate Name(s) (1alpha,3alpha,5alpha)-3-hydroxy-1-methylandrostan-17-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H32O2
InChI InChI=1S/C20H32O2/c1-12-10-14(21)11-13-4-5-15-16-6-7-18(22)19(16,2)9-8-17(15)20(12,13)3/h12-17,21H,4-11H2,1-3H3/t12-,13-,14+,15-,16-,17-,19-,20-/m0/s1
InChIKey UBSQZFBBZMBPFF-XHSSWRBBSA-N
Molecular Weight 304.474 g/mol
SMILES O[C@@]1(C[C@@]([C@@]2([C@@]3([C@@]([C@@]4(CCC([C@]4(CC3)C)=O)[H])([H])CC[C@]2(C1)[H])[H])C)(C)[H])[H]
SPLASH splash10-0lor-2963000000-d69245c35b818de5b06f
Source of Spectrum O-31-309-0
Wiley ID 1306959