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IPLTYTRWDPQMRV-PDOVPGRSSA-N
SpectraBase Compound ID 2saPHxjKrOP
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

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID D0MyJaF2SVa
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