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14-Oxo-des-D-androstan-3.beta.-yl acetate
SpectraBase Compound ID 1gHfEAo4Tc9
InChI InChI=1S/C18H28O3/c1-11-4-7-16-15(17(11)20)6-5-13-10-14(21-12(2)19)8-9-18(13,16)3/h11,13-16H,4-10H2,1-3H3/t11?,13-,14-,15+,16-,18-/m0/s1
InChIKey QUZKFSVCFCSIAE-APQCPLLASA-N
Mol Weight 292.42 g/mol
Molecular Formula C18H28O3
Exact Mass 292.203845 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 56xG4H9hFM9
Name 14-Oxo-des-D-androstan-3.beta.-yl acetate
Alternate Name(s) (2S,4aS,4bS,8aR,10aS)-4a,7-dimethyl-8-oxotetradecahydro-2-phenanthrenyl acetate
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Formula C18H28O3
InChI InChI=1S/C18H28O3/c1-11-4-7-16-15(17(11)20)6-5-13-10-14(21-12(2)19)8-9-18(13,16)3/h11,13-16H,4-10H2,1-3H3/t11?,13-,14-,15+,16-,18-/m0/s1
InChIKey QUZKFSVCFCSIAE-APQCPLLASA-N
Molecular Weight 292.419 g/mol
SMILES [C@]12([C@@]3([C@@](C(=O)C(CC3)C)([H])CC[C@]1(C[C@@](OC(=O)C)(CC2)[H])[H])[H])C
SPLASH splash10-003r-6940000000-467be6c60c3a504c6ce1
Source of Spectrum G-64-109-9
Wiley ID 749535