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3-{[(t-Butyl)dimethylsilyl]oxy}-17-hydroxypregna-5-en-21-al
SpectraBase Compound ID EvFcTvs0sOT
InChI InChI=1S/C27H46O3Si/c1-24(2,3)31(6,7)30-20-10-13-25(4)19(18-20)8-9-21-22(25)11-14-26(5)23(21)12-15-27(26,29)16-17-28/h8,17,20-23,29H,9-16,18H2,1-7H3/t20?,21-,22+,23+,25+,26+,27+/m1/s1
InChIKey FEDWYOBIFZAZEX-KCWLKQJESA-N
Mol Weight 446.7 g/mol
Molecular Formula C27H46O3Si
Exact Mass 446.321622 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9dnJDWfmdHx
Name 3-{[(t-Butyl)dimethylsilyl]oxy}-17-hydroxypregna-5-en-21-al
Alternate Name(s) 3-{[tert-butyl(dimethyl)silyl]oxy}-17-hydroxypregn-5-en-21-al
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H46O3Si
InChI InChI=1S/C27H46O3Si/c1-24(2,3)31(6,7)30-20-10-13-25(4)19(18-20)8-9-21-22(25)11-14-26(5)23(21)12-15-27(26,29)16-17-28/h8,17,20-23,29H,9-16,18H2,1-7H3/t20?,21-,22+,23+,25+,26+,27+/m1/s1
InChIKey FEDWYOBIFZAZEX-KCWLKQJESA-N
Molecular Weight 446.747 g/mol
SMILES O[C@@]1(CC[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])CC=O
SPLASH splash10-004i-9002100000-b8b8567270afeba5fc4b
Source of Spectrum H-87-3002-9
Wiley ID 1564174