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{(2,6-ME2C6H3O)3P}PD(ETA(2),ETA(2)-C7H12)
SpectraBase Compound ID 4lnmJvcBfyu
InChI InChI=1S/C24H28O3P.C7H12.Pd/c1-16-10-7-11-17(2)22(16)25-28(26-23-18(3)12-8-13-19(23)4)27-24-20(5)14-9-15-21(24)6;1-3-5-7-6-4-2;/h7-15,28H,1-6H3;3-4H,1-2,5-7H2;/q+1;;-1
InChIKey MPUWOUNTXCNPAX-UHFFFAOYSA-N
Mol Weight 598.1 g/mol
Molecular Formula C31H40O3PPd
Exact Mass 597.174987 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9wDmi09NBVi
Name {(2,6-ME2C6H3O)3P}PD(ETA(2),ETA(2)-C7H12)
Compound Number 2 11
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H39O3PPd
InChI InChI=1S/C24H28O3P.C7H12.Pd/c1-16-10-7-11-17(2)22(16)25-28(26-23-18(3)12-8-13-19(23)4)27-24-20(5)14-9-15-21(24)6;1-3-5-7-6-4-2;/h7-15,28H,1-6H3;3-4H,1-2,5-7H2;/q+1;;-1
InChIKey MPUWOUNTXCNPAX-UHFFFAOYSA-N
Literature Reference Author J.KRAUSE,G.CESTARIC,K.J.HAACK,K.SEEVOGEL,W.STORM,K.R.POERSCH KE
Literature Reference Citation J.AM.CHEM.SOC.,121,9807(1999)
Literature Reference DOI 10.1021/ja983939h
Molecular Weight 597.043 g/mol
Solvent THF-D8
Source File Reference UWSI5031