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[1-Isopropyl-3-methyl-4-(diphenylphosphinoyl)imidazol-2-ylidene]-[(1,2,5,6-)-1,5-cyclooctadiene]chloroiridium(I)
SpectraBase Compound ID JjhkULYegtQ
InChI InChI=1S/C19H22N2OP.C8H12.ClH.Ir/c1-16(2)21-14-19(20(3)15-21)23(22,17-10-6-4-7-11-17)18-12-8-5-9-13-18;1-2-4-6-8-7-5-3-1;;/h4-16H,1-3H3;1-2,7-8H,3-6H2;1H;/q-1;;;+2/p-1/b;2-1-,8-7-;;
InChIKey GWKBEAFCCTXRFT-ONEVTFJLSA-M
Mol Weight 661.23 g/mol
Molecular Formula C27H34ClIrN2OP
Exact Mass 661.172652 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EOJ3bHoDOYF
Name [1-Isopropyl-3-methyl-4-(diphenylphosphinoyl)imidazol-2-ylidene]-[(1,2,5,6-)-1,5-cyclooctadiene]chloroiridium(I)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H34ClIrN2OP
InChI InChI=1S/C19H22N2OP.C8H12.ClH.Ir/c1-16(2)21-14-19(20(3)15-21)23(22,17-10-6-4-7-11-17)18-12-8-5-9-13-18;1-2-4-6-8-7-5-3-1;;/h4-16H,1-3H3;1-2,7-8H,3-6H2;1H;/q-1;;;+2/p-1/b;2-1-,8-7-;;
InChIKey GWKBEAFCCTXRFT-ONEVTFJLSA-M
Molecular Weight 661.226 g/mol
SMILES C1\C=C/CC\C=C/C1.C=1(N([CH-]N(C1)C(C)C)C)P(c1ccccc1)(c1ccccc1)=O.[Ir+2].[Cl-]
SPLASH splash10-03fr-0028009000-f6ba9edfa4d52795caf2
Source of Spectrum U2-2014-4981-5b
Wiley ID 1789094