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5.alpha.-Androstan-12,17-dione 12-ethylene acetal
SpectraBase Compound ID Dur8iJOk7Re
InChI InChI=1S/C21H32O3/c1-19-10-4-3-5-14(19)6-7-15-16-8-9-18(22)20(16,2)21(13-17(15)19)23-11-12-24-21/h14-17H,3-13H2,1-2H3/t14-,15+,16+,17+,19+,20+/m1/s1
InChIKey MNHSCKIHPSTOBE-YLQUGHGXSA-N
Mol Weight 332.5 g/mol
Molecular Formula C21H32O3
Exact Mass 332.235145 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D92l4jDKccR
Name 5.alpha.-Androstan-12,17-dione 12-ethylene acetal
Alternate Name(s) (1'S,2'S,7'R,10'R,11'S,15'S)-2',15'-dimethylspiro[1,3-dioxolane-2,16'-tetracyclo[8.7.0.0(2,7).0(11,15)]heptadecane]-14'-one
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Formula C21H32O3
InChI InChI=1S/C21H32O3/c1-19-10-4-3-5-14(19)6-7-15-16-8-9-18(22)20(16,2)21(13-17(15)19)23-11-12-24-21/h14-17H,3-13H2,1-2H3/t14-,15+,16+,17+,19+,20+/m1/s1
InChIKey MNHSCKIHPSTOBE-YLQUGHGXSA-N
Molecular Weight 332.484 g/mol
SMILES [C@]12(C3(C[C@]4([C@]([C@@]2(CCC1=O)[H])(CC[C@]1(CCCC[C@]41C)[H])[H])[H])OCCO3)C
SPLASH splash10-008a-6259000000-2dc79c2919c1a582168d
Source of Spectrum AN-92-194-0
Wiley ID 1329777