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3-{[(t-Butyl)dimethylsilyl]oxy}-pregna-5,17(20)-dien-21-al
SpectraBase Compound ID DyW8v5XadRX
InChI InChI=1S/C27H44O2Si/c1-25(2,3)30(6,7)29-21-12-15-27(5)20(18-21)8-10-22-23-11-9-19(14-17-28)26(23,4)16-13-24(22)27/h8,14,17,21-24H,9-13,15-16,18H2,1-7H3/b19-14+/t21?,22-,23-,24-,26+,27-/m0/s1
InChIKey MTNBHNGASAUJFH-IJGUHLRZSA-N
Mol Weight 428.7 g/mol
Molecular Formula C27H44O2Si
Exact Mass 428.311057 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HsQrljU6mqt
Name 3-{[(t-Butyl)dimethylsilyl]oxy}-pregna-5,17(20)-dien-21-al
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H44O2Si
InChI InChI=1S/C27H44O2Si/c1-25(2,3)30(6,7)29-21-12-15-27(5)20(18-21)8-10-22-23-11-9-19(14-17-28)26(23,4)16-13-24(22)27/h8,14,17,21-24H,9-13,15-16,18H2,1-7H3/b19-14+/t21?,22-,23-,24-,26+,27-/m0/s1
InChIKey MTNBHNGASAUJFH-IJGUHLRZSA-N
Molecular Weight 428.732 g/mol
SMILES C1(CC[C@]2(C(C1)=CC[C@]1([C@@]3(CC\C(=C/C=O)[C@@]3(C)CC[C@]21[H])[H])[H])C)O[Si](C)(C)C(C)(C)C
SPLASH splash10-004i-9003000000-aee91802a196cfe73df5
Source of Spectrum H-87-3002-9
Synonyms (17E)-3-{[tert-butyl(dimethyl)silyl]oxy}pregna-5,17-dien-21-al
Wiley ID 1564173