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CP 55,940 tri-TMS-derivative
SpectraBase Compound ID kDv1E2EYQC
InChI InChI=1S/C33H64O3Si3/c1-13-14-15-16-23-33(2,3)28-20-22-30(32(25-28)36-39(10,11)12)31-26-29(35-38(7,8)9)21-19-27(31)18-17-24-34-37(4,5)6/h20,22,25,27,29,31H,13-19,21,23-24,26H2,1-12H3/t27-,29-,31-/m1/s1
InChIKey AGOIKXSOUBIFCG-MPGAWZFDSA-N
Mol Weight 593.1 g/mol
Molecular Formula C33H64O3Si3
Exact Mass 592.416326 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B3MvmThlOL8
Name CP 55,940 tri-TMS-derivative
Alternate Name(s) Trimethyl(5-(2-methyloctan-2-yl)-2-((1R,2R,5R)-5-((trimethylsilyl)oxy)-2-(3-((trimethylsilyl)oxy)propyl)cyclohexyl)phenoxy)silane
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Formula C33H64O3Si3
InChI InChI=1S/C33H64O3Si3/c1-13-14-15-16-23-33(2,3)28-20-22-30(32(25-28)36-39(10,11)12)31-26-29(35-38(7,8)9)21-19-27(31)18-17-24-34-37(4,5)6/h20,22,25,27,29,31H,13-19,21,23-24,26H2,1-12H3/t27-,29-,31-/m1/s1
InChIKey AGOIKXSOUBIFCG-MPGAWZFDSA-N
Molecular Weight 593.127 g/mol
SMILES c1c(c(cc(c1)C(CCCCCC)(C)C)O[Si](C)(C)C)[C@]1([C@@](CC[C@](C1)(O[Si](C)(C)C)[H])(CCCO[Si](C)(C)C)[H])[H]
SPLASH splash10-0103-6696230000-3866d2a4dde993b45eed
Source of Spectrum SWG-33-2936-0
Wiley ID 1809927