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Epitestosterone 3,5-dienol, O,O'-bis-TBS
SpectraBase Compound ID 5trIIeJC6kX
InChI InChI=1S/C31H56O2Si2/c1-28(2,3)34(9,10)32-23-17-19-30(7)22(21-23)13-14-24-25-15-16-27(31(25,8)20-18-26(24)30)33-35(11,12)29(4,5)6/h13,21,24-27H,14-20H2,1-12H3/t24?,25?,26?,27-,30+,31+/m1/s1
InChIKey HAPKJTXIXLQIKC-GDCZLOQASA-N
Mol Weight 517.0 g/mol
Molecular Formula C31H56O2Si2
Exact Mass 516.381884 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EYFQTZH65x2
Name Epitestosterone 3,5-dienol, O,O'-bis-TBS
Copyright Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 516.381884111 u
Formula C31H56O2Si2
InChI InChI=1S/C31H56O2Si2/c1-28(2,3)34(9,10)32-23-17-19-30(7)22(21-23)13-14-24-25-15-16-27(31(25,8)20-18-26(24)30)33-35(11,12)29(4,5)6/h13,21,24-27H,14-20H2,1-12H3/t24?,25?,26?,27-,30+,31+/m1/s1
InChIKey HAPKJTXIXLQIKC-GDCZLOQASA-N
Molecular Weight 516.957 g/mol
Nominal Mass 516 u
Number of Peaks 44
SMILES CC(C)(C)[Si](C)(C)O[C@]1([C@]2(CCC3[C@]4(CCC(=CC4=CCC3C2CC1)O[Si](C(C)(C)C)(C)C)C)C)[H]
SPLASH splash10-014i-2000090000-fa77e985e1f2498f6d4b
Source File Reference DSHS_50_0909
Source of Spectrum Dr. M.K.Parr, Dr. G.Opfermann, Prof. W.Schaenzer, DSHS Cologne, Germany
Wiley ID 50_909