SpectraBase Compound ID | 2saPHxjKrOP |
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InChI | InChI=1S/C89H94N2O19Si/c1-6-50-99-85-72(90-81(93)65-44-26-27-45-66(65)82(90)94)77(100-53-61-36-18-9-19-37-61)74(69(104-85)55-97-51-59-32-14-7-15-33-59)107-86-73(91-83(95)67-46-28-29-47-68(67)84(91)96)78(101-54-62-38-20-10-21-39-62)75(70(105-86)56-98-52-60-34-16-8-17-35-60)108-87-80(103-58(2)92)79(76-71(106-87)57-102-89(109-76)48-30-13-31-49-89)110-111(88(3,4)5,63-40-22-11-23-41-63)64-42-24-12-25-43-64/h6-12,14-29,32-47,69-80,85-87H,1,13,30-31,48-57H2,2-5H3/t69-,70+,71-,72-,73+,74-,75+,76-,77-,78+,79+,80+,85-,86-,87+/m0/s1 |
InChIKey | IPLTYTRWDPQMRV-PDOVPGRSSA-N |
Mol Weight | 1523.8 g/mol |
Molecular Formula | C89H94N2O19Si |
Exact Mass | 1522.622005 g/mol |
SpectraBase Spectrum ID | D0MyJaF2SVa |
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Name | IPLTYTRWDPQMRV-PDOVPGRSSA-N |
Compound Number | 14 |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C89H94N2O19Si |
InChI | InChI=1S/C89H94N2O19Si/c1-6-50-99-85-72(90-81(93)65-44-26-27-45-66(65)82(90)94)77(100-53-61-36-18-9-19-37-61)74(69(104-85)55-97-51-59-32-14-7-15-33-59)107-86-73(91-83(95)67-46-28-29-47-68(67)84(91)96)78(101-54-62-38-20-10-21-39-62)75(70(105-86)56-98-52-60-34-16-8-17-35-60)108-87-80(103-58(2)92)79(76-71(106-87)57-102-89(109-76)48-30-13-31-49-89)110-111(88(3,4)5,63-40-22-11-23-41-63)64-42-24-12-25-43-64/h6-12,14-29,32-47,69-80,85-87H,1,13,30-31,48-57H2,2-5H3/t69-,70+,71-,72-,73+,74-,75+,76-,77-,78+,79+,80+,85-,86-,87+/m0/s1 |
InChIKey | IPLTYTRWDPQMRV-PDOVPGRSSA-N |
Literature Reference Author | I.MATSUO,M.WADA,S.MANABE,Y.YAMAGUCHI,K.OTAKE,K.KATO,Y.ITO |
Literature Reference Citation | J.AM.CHEM.SOC.,125,3402(2003) |
Literature Reference DOI | 10.1021/ja021288q |
Molecular Weight | 1523.813 g/mol |
Sample ID | 30286 |
Solvent | CDCl3 |