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(8S,20R,22.xi.)-Des-A,B-8-[(triethylsilyl)oxy]-22-cyano-25-[(triethylsilyl)oxy]-cholestane
SpectraBase Compound ID 90SpCrJQYZD
InChI InChI=1S/C31H61NO2Si2/c1-11-35(12-2,13-3)33-29-18-17-22-31(10)27(19-20-28(29)31)25(7)26(24-32)21-23-30(8,9)34-36(14-4,15-5)16-6/h25-29H,11-23H2,1-10H3/t25-,26?,27-,28+,29+,31-/m1/s1
InChIKey GLFSXUCIOVWLHI-MGWWHURRSA-N
Mol Weight 536.0 g/mol
Molecular Formula C31H61NO2Si2
Exact Mass 535.424083 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Bh9gGmgN5K8
Name (8S,20R,22.xi.)-Des-A,B-8-[(triethylsilyl)oxy]-22-cyano-25-[(triethylsilyl)oxy]-cholestane
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Formula C31H61NO2Si2
InChI InChI=1S/C31H61NO2Si2/c1-11-35(12-2,13-3)33-29-18-17-22-31(10)27(19-20-28(29)31)25(7)26(24-32)21-23-30(8,9)34-36(14-4,15-5)16-6/h25-29H,11-23H2,1-10H3/t25-,26?,27-,28+,29+,31-/m1/s1
InChIKey GLFSXUCIOVWLHI-MGWWHURRSA-N
Ionization Type EI
Molecular Weight 536.004 g/mol
SMILES C1C[C@]2([C@]([C@](C1)(O[Si](CC)(CC)CC)[H])(CC[C@@]2([C@](C)(C(CCC(O[Si](CC)(CC)CC)(C)C)C#N)[H])[H])[H])C
SPLASH splash10-0fk9-0916100000-c185b48c85d49f1d20fc
Sample Comments major
Source of Spectrum US2012165300A1
Wiley ID 1849452