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PDI(C6H5)(P,S)

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PDI(C6H5)(P,S)
SpectraBase Compound ID IU2XaCsM4VN
InChI InChI=1S/C33H35O9PS.C6H5.HI.Pd/c1-21(34)38-19-28-30(39-22(2)35)31(40-23(3)36)32(41-24(4)37)33(42-28)44-20-25-13-11-12-18-29(25)43(26-14-7-5-8-15-26)27-16-9-6-10-17-27;1-2-4-6-5-3-1;;/h5-18,28,30-33H,19-20H2,1-4H3;1-5H;1H;
InChIKey XOCMLNNLWMNUGP-UHFFFAOYSA-N
Mol Weight 950.1 g/mol
Molecular Formula C39H41IO9PPdS
Exact Mass 949.028841 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5D8d6ZZqJqv
Name PDI(C6H5)(P,S)
Compound Number 2C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C39H40IO9PPdS
InChI InChI=1S/C33H35O9PS.C6H5.HI.Pd/c1-21(34)38-19-28-30(39-22(2)35)31(40-23(3)36)32(41-24(4)37)33(42-28)44-20-25-13-11-12-18-29(25)43(26-14-7-5-8-15-26)27-16-9-6-10-17-27;1-2-4-6-5-3-1;;/h5-18,28,30-33H,19-20H2,1-4H3;1-5H;1H;
InChIKey XOCMLNNLWMNUGP-UHFFFAOYSA-N
Literature Reference Author E.MARTINEZ-VIVIENTE,P.S.PREGOSIN,M.TSCHOERNER
Literature Reference Citation MAGN.RES.CHEM.,38,23(2000)
Literature Reference DOI 10.1002/(sici)1097-458x(200001)38:1<23::aid-mrc606>3.0.co;2-x
Molecular Weight 949.099 g/mol
Solvent CD2Cl2