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(2,3-Dihydro-2,2,7,8,12,13,17-heptamethyl-18-azaporphyrinato)nickel(II)
SpectraBase Compound ID 4CO8sxQopwP
InChI InChI=1S/C26H29N5.Ni/c1-13-14(2)20-9-21-15(3)16(4)22(30-21)10-23-17(5)27-25(31-23)11-24-26(6,7)12-18(28-24)8-19(13)29-20;/h8-11,29H,12H2,1-7H3,(H,27,31);/q;+2/p+2
InChIKey DTLPXPKTILSDHF-UHFFFAOYSA-P
Mol Weight 472.26 g/mol
Molecular Formula C26H31N5Ni
Exact Mass 471.193288 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HPqA6UE7Wa9
Name (2,3-Dihydro-2,2,7,8,12,13,17-heptamethyl-18-azaporphyrinato)nickel(II)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H31N5Ni
InChI InChI=1S/C26H29N5.Ni/c1-13-14(2)20-9-21-15(3)16(4)22(30-21)10-23-17(5)27-25(31-23)11-24-26(6,7)12-18(28-24)8-19(13)29-20;/h8-11,29H,12H2,1-7H3,(H,27,31);/q;+2/p+2
InChIKey DTLPXPKTILSDHF-UHFFFAOYSA-P
Molecular Weight 472.262 g/mol
SMILES [NH2+]1\C2=C/C3=N\C(=C/c4c(nc([nH2+]4)\C=C\4N=C(\C=C/1C(=C2C)C)CC4(C)C)C)C(=C3C)C.[Ni+2]
SPLASH splash10-014i-0030900000-61ccba3606f584c8c701
Source of Spectrum H-97-195-11
Wiley ID 1784906