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3-{[(t-Butyl)dimethylsilyl]oxy}-pregna-5,17(20)-dien-21-ol
SpectraBase Compound ID IlonBfYXbU4
InChI InChI=1S/C27H46O2Si/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/h8,14,21-24,28H,9-13,15-18H2,1-7H3/b19-14+/t21?,22-,23-,24-,26+,27-/m0/s1
InChIKey NSTUSOVUERFLSI-IJGUHLRZSA-N
Mol Weight 430.7 g/mol
Molecular Formula C27H46O2Si
Exact Mass 430.326707 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IEUlAL9YXH8
Name 3-{[(t-Butyl)dimethylsilyl]oxy}-pregna-5,17(20)-dien-21-ol
Alternate Name(s) (17E)-3-{[tert-butyl(dimethyl)silyl]oxy}pregna-5,17-dien-21-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H46O2Si
InChI InChI=1S/C27H46O2Si/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/h8,14,21-24,28H,9-13,15-18H2,1-7H3/b19-14+/t21?,22-,23-,24-,26+,27-/m0/s1
InChIKey NSTUSOVUERFLSI-IJGUHLRZSA-N
Molecular Weight 430.748 g/mol
SMILES OC\C=C/1CC[C@]2([C@@]3(CC=C4CC(CC[C@@]4([C@]3(CC[C@]12C)[H])C)O[Si](C)(C)C(C)(C)C)[H])[H]
SPLASH splash10-00fr-5009000000-64ce6aa14040ee32db02
Source of Spectrum H-87-2999-9
Wiley ID 1564187