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Magnesium, [5,10,15,20-tetrakis(4-chlorophenyl)-21H,23H-porphinato(2-)-N21,N22,N23,N24]-, (SP-4-1)-
SpectraBase Compound ID FEbM2jtD0Na
InChI InChI=1S/C44H24Cl4N4.Mg/c45-29-9-1-25(2-10-29)41-33-17-19-35(49-33)42(26-3-11-30(46)12-4-26)37-21-23-39(51-37)44(28-7-15-32(48)16-8-28)40-24-22-38(52-40)43(36-20-18-34(41)50-36)27-5-13-31(47)14-6-27;/h1-24H;/q-2;+2/b41-33-,41-34-,42-35-,42-37-,43-36-,43-38-,44-39-,44-40-;
InChIKey HYYPGSHLYRAYEO-DAJBKUBHSA-N
Mol Weight 774.8 g/mol
Molecular Formula C44H24Cl4MgN4
Exact Mass 772.060549 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1IzA1073MRM
Name Magnesium, [5,10,15,20-tetrakis(4-chlorophenyl)-21H,23H-porphinato(2-)-N21,N22,N23,N24]-, (SP-4-1)-
CAS Registry Number 39479-01-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C44H24Cl4MgN4
InChI InChI=1S/C44H24Cl4N4.Mg/c45-29-9-1-25(2-10-29)41-33-17-19-35(49-33)42(26-3-11-30(46)12-4-26)37-21-23-39(51-37)44(28-7-15-32(48)16-8-28)40-24-22-38(52-40)43(36-20-18-34(41)50-36)27-5-13-31(47)14-6-27;/h1-24H;/q-2;+2/b41-33-,41-34-,42-35-,42-37-,43-36-,43-38-,44-39-,44-40-;
InChIKey HYYPGSHLYRAYEO-DAJBKUBHSA-N
Molecular Weight 774.821 g/mol
SMILES c12[n]3[Mg][n]4c(c(c5nc(c2-c2ccc(cc2)Cl)cc5)-c2ccc(cc2)Cl)ccc4c(c2nc(c(c3cc1)-c1ccc(cc1)Cl)cc2)-c1ccc(cc1)Cl
SPLASH splash10-00b9-0011000900-51776a09b10d0fed966e
Source of Spectrum O-9-79-3
Synonyms Magnesium, [5,10,15,20-tetrakis(p-chlorophenyl)porphinato(2-)]-
Wiley ID 1416748