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17.beta.-Methyl-5.beta.-androst-1-en-17.alpha.-ol-3-one, O-TMS, O3-enol-TMS
SpectraBase Compound ID BFJWpCItrr9
InChI InChI=1S/C26H46O2Si2/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/h12,15,18-19,21-23H,10-11,13-14,16-17H2,1-9H3/t19-,21?,22?,23?,24+,25+,26-/m1/s1
InChIKey LBFJZCFDESSUPM-RUXVNMMHSA-N
Mol Weight 446.8 g/mol
Molecular Formula C26H46O2Si2
Exact Mass 446.303634 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6HeBNCCq8
Name 17.beta.-Methyl-5.beta.-androst-1-en-17.alpha.-ol-3-one, O-TMS, O3-enol-TMS
Copyright Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 446.303633789 u
Formula C26H46O2Si2
InChI InChI=1S/C26H46O2Si2/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/h12,15,18-19,21-23H,10-11,13-14,16-17H2,1-9H3/t19-,21?,22?,23?,24+,25+,26-/m1/s1
InChIKey LBFJZCFDESSUPM-RUXVNMMHSA-N
Molecular Weight 446.822 g/mol
Nominal Mass 446 u
Number of Peaks 43
SMILES [C@]1(O[Si](C)(C)C)(C)[C@]2(CCC3[C@]4(C=CC(=C[C@@]4([H])CCC3C2CC1)O[Si](C)(C)C)C)C
SPLASH splash10-0006-4900200000-3313819ae2c536b48b92
Source File Reference DSHS_50_0423
Source of Spectrum Dr. M.K.Parr, Dr. G.Opfermann, Prof. W.Schaenzer, DSHS Cologne, Germany
Synonyms Epimetenolon, O-TMS, O3-enol-TMS
Wiley ID 50_423