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CP*-IR-(N-TOL-(CO)-N-TOL)

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CP*-IR-(N-TOL-(CO)-N-TOL)
SpectraBase Compound ID 5zbpBWFRtUp
InChI InChI=1S/C15H15N2O.C10H15.Ir/c1-11-3-7-13(8-4-11)16-15(18)17-14-9-5-12(2)6-10-14;1-6-7(2)9(4)10(5)8(6)3;/h3-10H,1-2H3,(H-,16,17,18);1-5H3;/q-1;;+2/p-1
InChIKey OQMKQBVIFMJIJA-UHFFFAOYSA-M
Mol Weight 565.74 g/mol
Molecular Formula C25H29IrN2O
Exact Mass 566.190913 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID L4GUm6or6lR
Name CP*-IR-(N-TOL-(CO)-N-TOL)
Compound Number 2A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H29IrN2O
InChI InChI=1S/C15H15N2O.C10H15.Ir/c1-11-3-7-13(8-4-11)16-15(18)17-14-9-5-12(2)6-10-14;1-6-7(2)9(4)10(5)8(6)3;/h3-10H,1-2H3,(H-,16,17,18);1-5H3;/q-1;;+2/p-1
InChIKey OQMKQBVIFMJIJA-UHFFFAOYSA-M
Literature Reference Author A.W.HOLLAND,R.G.BERGMAN
Literature Reference Citation J.AM.CHEM.SOC.,124,9010(2002)
Literature Reference DOI 10.1021/ja026178y
Molecular Weight 565.738 g/mol
Sample ID 34046
Solvent CD2Cl2