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2,3,6,7-tetrakis[(4'-Nitroanilino]-1,4,5,8-tetraazafulvalene
SpectraBase Compound ID ifL1hCl69t
InChI InChI=1S/C30H20N12O8/c43-39(44)21-9-1-17(2-10-21)31-25-26(32-18-3-11-22(12-4-18)40(45)46)36-29(35-25)30-37-27(33-19-5-13-23(14-6-19)41(47)48)28(38-30)34-20-7-15-24(16-8-20)42(49)50/h1-16H,(H,31,35)(H,32,36)(H,33,37)(H,34,38)
InChIKey LPDJROUMZRHPBM-UHFFFAOYSA-N
Mol Weight 676.57 g/mol
Molecular Formula C30H20N12O8
Exact Mass 676.152706 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2dxBxoZ5xb7
Name 2,3,6,7-tetrakis[(4'-Nitroanilino]-1,4,5,8-tetraazafulvalene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H20N12O8
InChI InChI=1S/C30H20N12O8/c43-39(44)21-9-1-17(2-10-21)31-25-26(32-18-3-11-22(12-4-18)40(45)46)36-29(35-25)30-37-27(33-19-5-13-23(14-6-19)41(47)48)28(38-30)34-20-7-15-24(16-8-20)42(49)50/h1-16H,(H,31,35)(H,32,36)(H,33,37)(H,34,38)
InChIKey LPDJROUMZRHPBM-UHFFFAOYSA-N
Molecular Weight 676.566 g/mol
SMILES N(C1=NC(=C2N=C(C(=N2)Nc2ccc(N(=O)=O)cc2)Nc2ccc(N(=O)=O)cc2)N=C1Nc1ccc(N(=O)=O)cc1)c1ccc(N(=O)=O)cc1
SPLASH splash10-004j-0500019000-8fe38d17a7e00e2bd13a
Source of Spectrum U-1997-620-4
Wiley ID 769606