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[METHYL-3,5-BIS-(DI-TERT.-BUTYLPHOSPHINOMETHYL)-BENZOATE]-IRH(4);[CH(3)OC(O)-PCP]-IRH(4)
SpectraBase Compound ID 2UEi99GUBGo
InChI InChI=1S/C26H46O2P2.Ir.4H/c1-23(2,3)29(24(4,5)6)17-19-14-20(16-21(15-19)22(27)28-13)18-30(25(7,8)9)26(10,11)12;;;;;/h14-16H,17-18H2,1-13H3;;;;;/q;-2;;;;/p+2
InChIKey QMWBPPPIVOKWEB-UHFFFAOYSA-P
Mol Weight 650.9 g/mol
Molecular Formula C26H52IrO2P2
Exact Mass 651.307179 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID C61kH90EGzU
Name [METHYL-3,5-BIS-(DI-TERT.-BUTYLPHOSPHINOMETHYL)-BENZOATE]-IRH(4);[CH(3)OC(O)-PCP]-IRH(4)
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H50IrO2P2
InChI InChI=1S/C26H46O2P2.Ir.4H/c1-23(2,3)29(24(4,5)6)17-19-14-20(16-21(15-19)22(27)28-13)18-30(25(7,8)9)26(10,11)12;;;;;/h14-16H,17-18H2,1-13H3;;;;;/q;-2;;;;/p+2
InChIKey QMWBPPPIVOKWEB-UHFFFAOYSA-P
Literature Reference Author K.KROGH-JESPERSEN,M.SZERW,K.ZHU,B.SINGH,M.KANZELBERGER,N.DAR JI,P.D.ACHORD,K.B.RE
Literature Reference Citation J.AM.CHEM.SOC.,124,10797(2002)
Literature Reference DOI 10.1021/ja010547t
Solvent C6D6
Source File Reference UWSI34943