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5.beta.-Pregnane-3.alpha.,17.alpha.,20.alpha.-triol, O3,O20-bis-TMS
SpectraBase Compound ID 6nKO4EGreLJ
InChI InChI=1S/C27H52O3Si2/c1-19(29-31(4,5)6)27(28)17-14-24-22-11-10-20-18-21(30-32(7,8)9)12-15-25(20,2)23(22)13-16-26(24,27)3/h19-24,28H,10-18H2,1-9H3/t19-,20-,21-,22?,23?,24?,25+,26+,27+/m1/s1
InChIKey PYOLIIABYCOZPT-GXNRLZKASA-N
Mol Weight 480.9 g/mol
Molecular Formula C27H52O3Si2
Exact Mass 480.345499 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2Bz7J12qV6A
Name 5.beta.-Pregnane-3.alpha.,17.alpha.,20.alpha.-triol, O3,O20-bis-TMS
Copyright Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 480.345498601 u
Formula C27H52O3Si2
InChI InChI=1S/C27H52O3Si2/c1-19(29-31(4,5)6)27(28)17-14-24-22-11-10-20-18-21(30-32(7,8)9)12-15-25(20,2)23(22)13-16-26(24,27)3/h19-24,28H,10-18H2,1-9H3/t19-,20-,21-,22?,23?,24?,25+,26+,27+/m1/s1
InChIKey PYOLIIABYCOZPT-GXNRLZKASA-N
Molecular Weight 480.880 g/mol
Nominal Mass 480 u
Number of Peaks 44
SMILES O[C@]1([C@](O[Si](C)(C)C)(C)[H])CCC2C3CC[C@]4([H])C[C@](O[Si](C)(C)C)(CC[C@]4(C)C3CC[C@]12C)[H]
SPLASH splash10-0ab9-2491000000-d30c2fcae65654c84089
Source File Reference DSHS_50_1097
Source of Spectrum Dr. M.K.Parr, Dr. G.Opfermann, Prof. W.Schaenzer, DSHS Cologne, Germany
Wiley ID 50_1097