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16.beta.-Hydroxy-3,3-(ethylenedioxy)androstan-17-one
SpectraBase Compound ID AkF1e9raFMW
InChI InChI=1S/C21H32O4/c1-19-7-8-21(24-9-10-25-21)12-13(19)3-4-14-15(19)5-6-20(2)16(14)11-17(22)18(20)23/h13-17,22H,3-12H2,1-2H3/t13?,14-,15+,16+,17+,19+,20+/m1/s1
InChIKey RDKXWXXLOVAOJV-LUJOTGLPSA-N
Mol Weight 348.5 g/mol
Molecular Formula C21H32O4
Exact Mass 348.23006 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D3K0LJ8tBGW
Name 16.beta.-Hydroxy-3,3-(ethylenedioxy)androstan-17-one
Alternate Name(s) (1'S,2'S,10'R,11'S,13'S,15'S)-13'-hydroxy-2',15'-dimethylspiro[1,3-dioxolane-2,5'-tetracyclo[8.7.0.0(2,7).0(11,15)]heptadecane]-14'-one
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Formula C21H32O4
InChI InChI=1S/C21H32O4/c1-19-7-8-21(24-9-10-25-21)12-13(19)3-4-14-15(19)5-6-20(2)16(14)11-17(22)18(20)23/h13-17,22H,3-12H2,1-2H3/t13?,14-,15+,16+,17+,19+,20+/m1/s1
InChIKey RDKXWXXLOVAOJV-LUJOTGLPSA-N
Molecular Weight 348.483 g/mol
SMILES O[C@]1(C[C@]2([C@@]3(CCC4CC5(CC[C@@]4([C@]3(CC[C@@]2(C1=O)C)[H])C)OCCO5)[H])[H])[H]
SPLASH splash10-0002-9200000000-daa78a2fac1191400869
Source of Spectrum E1-35-2123-16
Wiley ID 1574266