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5-Androsten-3.beta., 17.beta.-bis[(tert.-butyldimethylsilyl)oxy]-16-one

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5-Androsten-3.beta., 17.beta.-bis[(tert.-butyldimethylsilyl)oxy]-16-one
SpectraBase Compound ID 6BPjK2eMXMx
InChI InChI=1S/C31H56O3Si2/c1-28(2,3)35(9,10)33-22-15-17-30(7)21(19-22)13-14-23-24(30)16-18-31(8)25(23)20-26(32)27(31)34-36(11,12)29(4,5)6/h13,22-25,27H,14-20H2,1-12H3
InChIKey FTACBUNWSBGGHC-UHFFFAOYSA-N
Mol Weight 533.0 g/mol
Molecular Formula C31H56O3Si2
Exact Mass 532.376799 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KbJZYfi9moU
Name 5-Androsten-3.beta., 17.beta.-bis[(tert.-butyldimethylsilyl)oxy]-16-one
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 532.376798730 u
Formula C31H56O3Si2
InChI InChI=1S/C31H56O3Si2/c1-28(2,3)35(9,10)33-22-15-17-30(7)21(19-22)13-14-23-24(30)16-18-31(8)25(23)20-26(32)27(31)34-36(11,12)29(4,5)6/h13,22-25,27H,14-20H2,1-12H3
InChIKey FTACBUNWSBGGHC-UHFFFAOYSA-N
Molecular Weight 532.956 g/mol
SMILES C1(O[Si](C)(C)C(C)(C)C)C2(C)C(C3C(C4(C(CC(O[Si](C)(C)C(C)(C)C)CC4)=CC3)C)CC2)CC1=O