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3-tert-Butyldimethylsiloxypregn-7-en-6,20-diol
SpectraBase Compound ID I0VHzaeWIYL
InChI InChI=1S/C27H48O3Si/c1-17(28)20-9-10-21-19-16-24(29)23-15-18(30-31(7,8)25(2,3)4)11-13-27(23,6)22(19)12-14-26(20,21)5/h16-18,20-24,28-29H,9-15H2,1-8H3/t17-,18+,20-,21?,22?,23-,24+,26-,27-/m1/s1
InChIKey FYVVAOFWOZJMSO-VFLBPCLBSA-N
Mol Weight 448.8 g/mol
Molecular Formula C27H48O3Si
Exact Mass 448.337272 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8abRyNcGsLt
Name 3-tert-Butyldimethylsiloxypregn-7-en-6,20-diol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H48O3Si
InChI InChI=1S/C27H48O3Si/c1-17(28)20-9-10-21-19-16-24(29)23-15-18(30-31(7,8)25(2,3)4)11-13-27(23,6)22(19)12-14-26(20,21)5/h16-18,20-24,28-29H,9-15H2,1-8H3/t17-,18+,20-,21?,22?,23-,24+,26-,27-/m1/s1
InChIKey FYVVAOFWOZJMSO-VFLBPCLBSA-N
Molecular Weight 448.763 g/mol
SMILES O[C@@]1([C@]2(C[C@](CC[C@@]2(C2C(C3[C@@]([C@@]([C@](O)(C)[H])(CC3)[H])(CC2)C)=C1)C)(O[Si](C(C)(C)C)(C)C)[H])[H])[H]
SPLASH splash10-015c-0009400000-41b667722937a5849f98
Source of Spectrum AT-32-5174-9
Synonyms (3beta,5alpha,6alpha)-3-{[tert-butyl(dimethyl)silyl]oxy}pregn-7-ene-6,20-diol
Wiley ID 836103