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Nickel, [2,8,12,18-tetraethyl-3,7,13,17-tetramethyl-21H,23H-porphinato(2-)-N21,N22,N23,N24]-, (SP-4-1)-
SpectraBase Compound ID 9F2p7xNGfY3
InChI InChI=1S/C32H36N4.Ni/c1-9-21-17(5)25-13-26-19(7)23(11-3)31(35-26)16-32-24(12-4)20(8)28(36-32)14-27-18(6)22(10-2)30(34-27)15-29(21)33-25;/h13-16H,9-12H2,1-8H3;/q-2;+2/b25-13-,26-13+,27-14+,28-14-,29-15-,30-15-,31-16-,32-16-;
InChIKey UJSAMZSDLWMABT-HFRMSCEJSA-N
Mol Weight 535.4 g/mol
Molecular Formula C32H36N4Ni
Exact Mass 534.229339 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6tC1WLPxEiw
Name Nickel, [2,8,12,18-tetraethyl-3,7,13,17-tetramethyl-21H,23H-porphinato(2-)-N21,N22,N23,N24]-, (SP-4-1)-
CAS Registry Number 22925-21-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C32H36N4Ni
InChI InChI=1S/C32H36N4.Ni/c1-9-21-17(5)25-13-26-19(7)23(11-3)31(35-26)16-32-24(12-4)20(8)28(36-32)14-27-18(6)22(10-2)30(34-27)15-29(21)33-25;/h13-16H,9-12H2,1-8H3;/q-2;+2/b25-13-,26-13+,27-14+,28-14-,29-15-,30-15-,31-16-,32-16-;
InChIKey UJSAMZSDLWMABT-HFRMSCEJSA-N
Molecular Weight 535.361 g/mol
SMILES CCc1c(C)c2cc3nc(cc4c(CC)c(C)c([n-]4)cc4nc(cc1[n-]2)c(CC)c4C)c(CC)c3C.[Ni+2]
SPLASH splash10-0019-0030290000-ca0d77b6b98a449787c7
Source of Spectrum SH-0-63-0
Synonyms Nickel, [2,8,12,18-tetraethyl-3,7,13,17-tetramethylporphinato(2-)]-
Wiley ID 1403864