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2,2-Hydroxymethylene-androsta-3,5-diene-3,17.beta.-diol, O',O'',O'''-tris-TMS
SpectraBase Compound ID IKW91dvSZ5N
InChI InChI=1S/C29H52O3Si3/c1-28-17-16-25-23(24(28)14-15-27(28)32-35(9,10)11)13-12-22-18-26(31-34(6,7)8)21(19-29(22,25)2)20-30-33(3,4)5/h12,18,20,23-25,27H,13-17,19H2,1-11H3/b21-20-/t23?,24?,25?,27-,28-,29-/m0/s1
InChIKey IVPMAAROPITDRY-XFKJINEXSA-N
Mol Weight 533.0 g/mol
Molecular Formula C29H52O3Si3
Exact Mass 532.322425 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LRoHE3nyOfh
Name 2,2-Hydroxymethylene-androsta-3,5-diene-3,17.beta.-diol, O',O'',O'''-tris-TMS
Copyright Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 532.322425136 u
Formula C29H52O3Si3
InChI InChI=1S/C29H52O3Si3/c1-28-17-16-25-23(24(28)14-15-27(28)32-35(9,10)11)13-12-22-18-26(31-34(6,7)8)21(19-29(22,25)2)20-30-33(3,4)5/h12,18,20,23-25,27H,13-17,19H2,1-11H3/b21-20-/t23?,24?,25?,27-,28-,29-/m0/s1
InChIKey IVPMAAROPITDRY-XFKJINEXSA-N
Molecular Weight 532.987 g/mol
Nominal Mass 532 u
Number of Peaks 32
SMILES C[Si](C)(C)O\C=C\1C[C@]2(C)C3CC[C@]4(C)[C@@](O[Si](C)(C)C)(CCC4C3CC=C2C=C1O[Si](C)(C)C)[H]
SPLASH splash10-001i-4000090000-573aaa475a4e268a1c74
Source File Reference DSHS_50_0396
Source of Spectrum Dr. M.K.Parr, Dr. G.Opfermann, Prof. W.Schaenzer, DSHS Cologne, Germany
Synonyms 2,2-Hydroxymethylene-testosterone 3,5 dienol, O',O'',O'''-tris-TMS
Wiley ID 50_396