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3.alpha.-Deutero-17.beta.-methyl-5.beta.-androst-1-ene-3.beta.,17.alpha.-diol, O,O'-bis-TMS
SpectraBase Compound ID 3vRiXCzC7XU
InChI InChI=1S/C26H48O2Si2/c1-24-15-12-20(27-29(4,5)6)18-19(24)10-11-21-22(24)13-16-25(2)23(21)14-17-26(25,3)28-30(7,8)9/h12,15,19-23H,10-11,13-14,16-18H2,1-9H3/t19-,20+,21?,22?,23?,24+,25+,26-/m1/s1/i20D
InChIKey FKXKDLQNCNDLSD-LFBYPPMZSA-N
Mol Weight 449.8 g/mol
Molecular Formula C26H472HO2Si2
Exact Mass 449.325561 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LKBXcjFHGMl
Name 3.alpha.-Deutero-17.beta.-methyl-5.beta.-androst-1-ene-3.beta.,17.alpha.-diol, O,O'-bis-TMS
Copyright Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 449.325560600 u
Formula C26H47[2H]O2Si2
InChI InChI=1S/C26H48O2Si2/c1-24-15-12-20(27-29(4,5)6)18-19(24)10-11-21-22(24)13-16-25(2)23(21)14-17-26(25,3)28-30(7,8)9/h12,15,19-23H,10-11,13-14,16-18H2,1-9H3/t19-,20+,21?,22?,23?,24+,25+,26-/m1/s1/i20D
InChIKey FKXKDLQNCNDLSD-LFBYPPMZSA-N
Molecular Weight 449.844 g/mol
Nominal Mass 449 u
Number of Peaks 44
SMILES [C@]1(O[Si](C)(C)C)(C)[C@]2(CCC3[C@]4(C=C[C@@](C[C@@]4([H])CCC3C2CC1)(O[Si](C)(C)C)[2H])C)C
SPLASH splash10-0006-3911000000-12821d7012a5de0bb2d8
Source File Reference DSHS_50_0716
Source of Spectrum Dr. M.K.Parr, Dr. G.Opfermann, Prof. W.Schaenzer, DSHS Cologne, Germany
Wiley ID 50_716