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17-BETA-(TERT.-BUTYLDIMETHYLSILYLOXY)-12,12-ETHYLENEDIOXY-ANDROSTA-1,4-DIEN-3-ONE
SpectraBase Compound ID dm04VmBmaQ
InChI InChI=1S/C27H42O4Si/c1-24(2,3)32(6,7)31-23-11-10-21-20-9-8-18-16-19(28)12-13-25(18,4)22(20)17-27(26(21,23)5)29-14-15-30-27/h12-13,16,20-23H,8-11,14-15,17H2,1-7H3/t20-,21-,22-,23-,25-,26-/m0/s1
InChIKey NHPNKNZLGKVHSD-IXKNJLPQSA-N
Mol Weight 458.7 g/mol
Molecular Formula C27H42O4Si
Exact Mass 458.285236 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4cCPDBhlrf6
Name 17.beta..-[(t-Butyldimethylsilyl)oxy]-12,12-(ethylenedioxy)androsta-1,4-dien-3-one
Alternate Name(s) (1'S,2'R,10'R,11'S,14'S,15'S)-14'-[(tert-butyldimethylsilyl)oxy]-2',15'-dimethylspiro[1,3-dioxolane-2,16'-tetracyclo[8.7.0.0(2,7).0(11,15)]heptadecane]-3',6'-dien-5'-one
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Formula C27H42O4Si
InChI InChI=1S/C27H42O4Si/c1-24(2,3)32(6,7)31-23-11-10-21-20-9-8-18-16-19(28)12-13-25(18,4)22(20)17-27(26(21,23)5)29-14-15-30-27/h12-13,16,20-23H,8-11,14-15,17H2,1-7H3/t20-,21-,22-,23-,25-,26-/m0/s1
InChIKey NHPNKNZLGKVHSD-IXKNJLPQSA-N
Molecular Weight 458.714 g/mol
SMILES [C@@]12(C3(C[C@@]4([C@]5(C=CC(C=C5CC[C@]4([C@@]1(CC[C@@]2(O[Si](C(C)(C)C)(C)C)[H])[H])[H])=O)C)[H])OCCO3)C
SPLASH splash10-05fr-9301000000-faea1df830c55fb605fd
Source of Spectrum B-51-358-12
Wiley ID 746144