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2-[bis(4,5-dicyano-1-methyl-2-imidazolyl)amino]-1-methylimidazole-4,5-dicarbonitrile
SpectraBase Compound ID G1XOAXm42Bl
InChI InChI=1S/C18H9N13/c1-28-13(7-22)10(4-19)25-16(28)31(17-26-11(5-20)14(8-23)29(17)2)18-27-12(6-21)15(9-24)30(18)3/h1-3H3
InChIKey QLFWBNYJWQSEHH-UHFFFAOYSA-N
Mol Weight 407.36 g/mol
Molecular Formula C18H9N13
Exact Mass 407.110387 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5XZlPPurIM5
Name 2-[bis(4,5-dicyano-1-methyl-2-imidazolyl)amino]-1-methylimidazole-4,5-dicarbonitrile
Alternate Name(s) 2-[bis(4,5-dicyano-1-methyl-imidazol-2-yl)amino]-1-methyl-imidazole-4,5-dicarbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H9N13
InChI InChI=1S/C18H9N13/c1-28-13(7-22)10(4-19)25-16(28)31(17-26-11(5-20)14(8-23)29(17)2)18-27-12(6-21)15(9-24)30(18)3/h1-3H3
InChIKey QLFWBNYJWQSEHH-UHFFFAOYSA-N
Molecular Weight 407.361 g/mol
SMILES c1(N(c2nc(C#N)c([n]2C)C#N)c2nc(C#N)c([n]2C)C#N)nc(C#N)c([n]1C)C#N
SPLASH splash10-0a4i-3420900000-31cf1bb56415ca96f2e7
Source of Spectrum J-59-4345-1
Wiley ID 1372501