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IR(DTBPA)(CH3)CL
SpectraBase Compound ID 8bbfE72ktmQ
InChI InChI=1S/C27H49OP2.CH3.ClH.Ir/c1-19-21(17-29(24(3,4)5)25(6,7)8)16-22(20(2)23(19)28-15)18-30(26(9,10)11)27(12,13)14;;;/h17-18H2,1-15H3;1H3;1H;/q;;;-1/p+1
InChIKey WTZPYFRNIGIPLI-UHFFFAOYSA-O
Mol Weight 696.4 g/mol
Molecular Formula C28H54ClIrOP2
Exact Mass 696.296767 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DVz1HD87c0C
Name IR(DTBPA)(CH3)CL
Compound Number 7B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H52ClIrOP2
InChI InChI=1S/C27H49OP2.CH3.ClH.Ir/c1-19-21(17-29(24(3,4)5)25(6,7)8)16-22(20(2)23(19)28-15)18-30(26(9,10)11)27(12,13)14;;;/h17-18H2,1-15H3;1H3;1H;/q;;;-1/p+1
InChIKey WTZPYFRNIGIPLI-UHFFFAOYSA-O
Literature Reference Author B.RYBTCHINSKI,A.VIGALOK,Y.BEN-DAVID,D.MILSTEIN
Literature Reference Citation J.AM.CHEM.SOC.,118,12406(1996)
Literature Reference DOI 10.1021/ja962253r
Molecular Weight 694.341 g/mol
Sample ID 54476
Solvent C6D6