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3,6-Bis[(trimethylsilyl)oxy]androstan-17-one
SpectraBase Compound ID BxreAETxxNT
InChI InChI=1S/C25H46O3Si2/c1-24-13-11-17(27-29(3,4)5)15-21(24)22(28-30(6,7)8)16-18-19-9-10-23(26)25(19,2)14-12-20(18)24/h17-22H,9-16H2,1-8H3/t17-,18-,19-,20-,21+,22-,24+,25-/m0/s1
InChIKey VAAAZTOWLPKEAV-LWSJNGCYSA-N
Mol Weight 450.8 g/mol
Molecular Formula C25H46O3Si2
Exact Mass 450.298548 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HTPBANq9G2H
Name 5.ALPHA.-ANDROSTANE-3.BETA.-6.ALPHA.-DIOL-17-ONE-3.BETA.,6.ALPHA.-DI-TRIMETHYLSILYL ETHER
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Exact Mass 450.298548408 u
Formula C25H46O3Si2
InChI InChI=1S/C25H46O3Si2/c1-24-13-11-17(27-29(3,4)5)15-21(24)22(28-30(6,7)8)16-18-19-9-10-23(26)25(19,2)14-12-20(18)24/h17-22H,9-16H2,1-8H3/t17-,18-,19-,20-,21+,22-,24+,25-/m0/s1
InChIKey VAAAZTOWLPKEAV-LWSJNGCYSA-N
Molecular Weight 450.810 g/mol
Nominal Mass 450 u
Number of Peaks 124
SMILES [C@]1(CC[C@@]2([C@]3(CC[C@@]4(C(CC[C@]4([C@@]3(C[C@@]([C@]2(C1)[H])(O[Si](C)(C)C)[H])[H])[H])=O)C)[H])C)(O[Si](C)(C)C)[H]
SPLASH splash10-0udi-8685900000-1285f8c0cc979759e353
Source File Reference LMCM-46216-134Q
Source of Spectrum Dr. Makin, London Hospital Medical College, UK
Synonyms 3,6-BIS[(TRIMETHYLSILYL)OXY]ANDROSTAN-17-ONE (3S,5S,6S,8R,9S,10R,13S,14S)-10,13-dimethyl-3,6-bis(trimethylsilyloxy)tetradecahydro-1H-cyclopenta[a]phenanthren-17(2H)-one
Wiley ID 4_2895