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5-{1-ethylenedimethylsiloxy-3,5,7,9,11,13,15-isobutylpentacyclo-[9.5.1.13,9.15,15.17,13]octasiloxane}-benzo[h]quinoline
SpectraBase Compound ID L0OkqmEKQOE
InChI InChI=1S/C47H87NO13Si10/c1-36(2)29-64-50-65(30-37(3)4)53-68(33-40(9)10)55-66(51-64,31-38(5)6)57-70(35-42(13)14)58-67(52-64,32-39(7)8)56-69(54-65,34-41(11)12)60-71(59-68,61-70)49-63(17,18)27-26-62(15,16)46-28-43-22-19-20-23-44(43)47-45(46)24-21-25-48-47/h19-25,28,36-42H,26-27,29-35H2,1-18H3/t64-,65-,66-,67-,68-,69+,70-,71+
InChIKey WZPFODBYQHLFMK-AWKUTRGISA-N
Mol Weight 1155.1 g/mol
Molecular Formula C47H87NO13Si10
Exact Mass 1153.387007 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E0acKkj1CmA
Name 5-{1-ethylenedimethylsiloxy-3,5,7,9,11,13,15-isobutylpentacyclo-[9.5.1.13,9.15,15.17,13]octasiloxane}-benzo[h]quinoline
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Formula C47H87NO13Si10
InChI InChI=1S/C47H87NO13Si10/c1-36(2)29-64-50-65(30-37(3)4)53-68(33-40(9)10)55-66(51-64,31-38(5)6)57-70(35-42(13)14)58-67(52-64,32-39(7)8)56-69(54-65,34-41(11)12)60-71(59-68,61-70)49-63(17,18)27-26-62(15,16)46-28-43-22-19-20-23-44(43)47-45(46)24-21-25-48-47/h19-25,28,36-42H,26-27,29-35H2,1-18H3/t64-,65-,66-,67-,68-,69+,70-,71+
InChIKey WZPFODBYQHLFMK-AWKUTRGISA-N
Literature Reference DOI 10.1002/adsc.201800286
Molecular Weight 1155.057 g/mol
SMILES C([Si@]12O[Si@]3(O[Si@@]4(O[Si@](O2)(O[Si@@]2(O[Si@](O[Si@@](O[Si@](O1)(O2)CC(C)C)(O3)O[Si](CC[Si](c1cc2c(c3c1cccn3)cccc2)(C)C)(C)C)(CC(C)C)O4)CC(C)C)CC(C)C)CC(C)C)CC(C)C)C(C)C
SPLASH splash10-000i-0193100000-5b7eb78be777ba4aa6cc
Source of Spectrum ASC-360-SM10-13
Synonyms 5-((2-(((3,5,7,9,11,13,15-heptaisobutyl-2,4,6,8,10,12,14,16,17,18,19,20-dodecaoxa-1,3,5,7,9,11,13,15-octasilapentacyclo[9.5.1.1(3,9).1(5,15).1(7,13)]icosan-1-yl)oxy)dimethylsilyl)ethyl)dimethylsilyl)benzo[h]quinoline
Wiley ID 1812024