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#8B.2PF6;1-[4-[TRIS-[4-[4-(DIETHOXYPHOSPHONO)-PHENYL]-PHENYL]-METHYL]-PHENYL]-1'-[4-[2-(2-PHENOXYETHOXY)-ETHOXY]-BENZYL]-4,4'-BIPYRIDINIUM-BIS-(HEXAFLUOROPHSPH
SpectraBase Compound ID INireJecbq
InChI InChI=1S/C82H85N2O12P3.F6P/c1-7-91-97(85,92-8-2)79-44-26-67(27-45-79)64-20-32-72(33-21-64)82(73-34-22-65(23-35-73)68-28-46-80(47-29-68)98(86,93-9-3)94-10-4,74-36-24-66(25-37-74)69-30-48-81(49-31-69)99(87,95-11-5)96-12-6)75-38-40-76(41-39-75)84-56-52-71(53-57-84)70-50-54-83(55-51-70)62-63-18-42-78(43-19-63)90-61-59-88-58-60-89-77-16-14-13-15-17-77;1-7(2,3,4,5)6/h13-57H,7-12,58-62H2,1-6H3;/q+1;-1
InChIKey JJNPBYGPIJIMOO-UHFFFAOYSA-N
Mol Weight 1528.5 g/mol
Molecular Formula C82H85F6N2O12P4
Exact Mass 1527.495718 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8Vm9Ri1H8VI
Name #8B.2PF6;1-[4-[TRIS-[4-[4-(DIETHOXYPHOSPHONO)-PHENYL]-PHENYL]-METHYL]-PHENYL]-1'-[4-[2-(2-PHENOXYETHOXY)-ETHOXY]-BENZYL]-4,4'-BIPYRIDINIUM-BIS-(HEXAFLUOROPHSPH
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C82H85F6N2O12P4
InChI InChI=1S/C82H85N2O12P3.F6P/c1-7-91-97(85,92-8-2)79-44-26-67(27-45-79)64-20-32-72(33-21-64)82(73-34-22-65(23-35-73)68-28-46-80(47-29-68)98(86,93-9-3)94-10-4,74-36-24-66(25-37-74)69-30-48-81(49-31-69)99(87,95-11-5)96-12-6)75-38-40-76(41-39-75)84-56-52-71(53-57-84)70-50-54-83(55-51-70)62-63-18-42-78(43-19-63)90-61-59-88-58-60-89-77-16-14-13-15-17-77;1-7(2,3,4,5)6/h13-57H,7-12,58-62H2,1-6H3;/q+1;-1
InChIKey JJNPBYGPIJIMOO-UHFFFAOYSA-N
Literature Reference Author B.LONG,K.NIKITIN,D.FITZMAURICE
Literature Reference Citation J.AM.CHEM.SOC.,125,5152(2003)
Literature Reference DOI 10.1021/ja028870z
Solvent CDCl3:CD3OD
Source File Reference UWLU40954