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IR-H-(CL)[KAPA(2)-(C,O)-CH=CHC(ME)=O]-(PPH3)2
SpectraBase Compound ID 9KfscpiWfxM
InChI InChI=1S/2C18H15P.C4H5O.ClH.Ir.H/c2*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-3-4(2)5;;;/h2*1-15H;1,3H,2H3;1H;;/q;;;;-1;/p+1
InChIKey AIOWOBUEWIIQRV-UHFFFAOYSA-O
Mol Weight 824.4 g/mol
Molecular Formula C40H38ClIrOP2
Exact Mass 824.171567 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9t8LTcbKQbA
Name IR-H-(CL)[KAPA(2)-(C,O)-CH=CHC(ME)=O]-(PPH3)2
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C40H36ClIrOP2
InChI InChI=1S/2C18H15P.C4H5O.ClH.Ir.H/c2*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-3-4(2)5;;;/h2*1-15H;1,3H,2H3;1H;;/q;;;;-1;/p+1
InChIKey AIOWOBUEWIIQRV-UHFFFAOYSA-O
Literature Reference Author B.PAPENFUHS,T.DIRNBERGER,H.WERNER
Literature Reference Citation CAN.J.CHEM.,84,205(2006)
Literature Reference DOI 10.1139/v05-234
Molecular Weight 822.346 g/mol
Sample ID 46671
Solvent CDCl3