John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=9acq9J9GpCi SpectraBase Spectrum ID=1k9zVTOxfRy

(accessed ).
CHLOROCADMIUM-(II)-6,11,16,21-TETRAPHENYL-META-BENZIPORPHYRIN
SpectraBase Compound ID 9acq9J9GpCi
InChI InChI=1S/C46H30N3.Cd.ClH/c1-5-14-31(15-6-1)43-35-22-13-23-36(30-35)44(32-16-7-2-8-17-32)38-25-27-40(48-38)46(34-20-11-4-12-21-34)42-29-28-41(49-42)45(33-18-9-3-10-19-33)39-26-24-37(43)47-39;;/h1-30H;;1H/q-1;+2;/p-1/b43-37-,44-38-,45-41-,46-42-;;
InChIKey MRAMZDRMVXDWCA-WPXGRPESSA-M
Mol Weight 772.6 g/mol
Molecular Formula C46H30CdClN3
Exact Mass 773.116187 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1k9zVTOxfRy
Name CHLOROCADMIUM-(II)-6,11,16,21-TETRAPHENYL-META-BENZIPORPHYRIN
Compound Number 5-CDCL
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C46H30CdClN3
InChI InChI=1S/C46H30N3.Cd.ClH/c1-5-14-31(15-6-1)43-35-22-13-23-36(30-35)44(32-16-7-2-8-17-32)38-25-27-40(48-38)46(34-20-11-4-12-21-34)42-29-28-41(49-42)45(33-18-9-3-10-19-33)39-26-24-37(43)47-39;;/h1-30H;;1H/q-1;+2;/p-1/b43-37-,44-38-,45-41-,46-42-;;
InChIKey MRAMZDRMVXDWCA-WPXGRPESSA-M
Literature Reference Author M.STEPIEN,L.LATOS-GRAZYNSKI,L.SZTERENBERG,J.PANEK,Z.LATAJKA
Literature Reference Citation J.AM.CHEM.SOC.,126,4566(2004)
Literature Reference DOI 10.1021/ja039384u
Molecular Weight 772.627 g/mol
Solvent CDCl3
Source File Reference UWMZ24252
SpectraBase Batch ID CGrFuvp69X8