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1,3-BIS-(4''-HYDROXYMETHYLPHOSPHINOYLOXYBIPHENYL-4'-CARBOXAMIDOMETHYL)-BENZENE-BIS-TETRABUTYLAMMONIUM-SALT
SpectraBase Compound ID 97nt0MiI0nq
InChI InChI=1S/C36H34N2O8P2.2C16H36N/c1-47(41,42)45-33-18-14-29(15-19-33)27-6-10-31(11-7-27)35(39)37-23-25-4-3-5-26(22-25)24-38-36(40)32-12-8-28(9-13-32)30-16-20-34(21-17-30)46-48(2,43)44;2*1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4/h3-22H,23-24H2,1-2H3,(H,37,39)(H,38,40)(H,41,42)(H,43,44);2*5-16H2,1-4H3/q;2*+1/p-2
InChIKey RCBIIJKTNNEQFM-UHFFFAOYSA-L
Mol Weight 1167.5 g/mol
Molecular Formula C68H104N4O8P2
Exact Mass 1166.73294 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2fCQdUdr9UK
Name 1,3-BIS-(4''-HYDROXYMETHYLPHOSPHINOYLOXYBIPHENYL-4'-CARBOXAMIDOMETHYL)-BENZENE-BIS-TETRABUTYLAMMONIUM-SALT
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C68H104N4O8P2
InChI InChI=1S/C36H34N2O8P2.2C16H36N/c1-47(41,42)45-33-18-14-29(15-19-33)27-6-10-31(11-7-27)35(39)37-23-25-4-3-5-26(22-25)24-38-36(40)32-12-8-28(9-13-32)30-16-20-34(21-17-30)46-48(2,43)44;2*1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4/h3-22H,23-24H2,1-2H3,(H,37,39)(H,38,40)(H,41,42)(H,43,44);2*5-16H2,1-4H3/q;2*+1/p-2
InChIKey RCBIIJKTNNEQFM-UHFFFAOYSA-L
Literature Reference Author O.MOLT,D.RUEBELING,T.SCHRADER
Literature Reference Citation J.AM.CHEM.SOC.,125,12086(2003)
Literature Reference DOI 10.1021/ja035212l
Solvent CD3OD
Source File Reference UWLU50552