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4-[(E)-(4,5-dimethyl-1,2,3-triazol-1-yl)iminomethyl]benzenecarbonitrile
SpectraBase Compound ID JztbmW2bK2k
InChI InChI=1S/C12H11N5/c1-9-10(2)17(16-15-9)14-8-12-5-3-11(7-13)4-6-12/h3-6,8H,1-2H3/b14-8+
InChIKey CWAAYHDYXUUGPG-RIYZIHGNSA-N
Mol Weight 225.25 g/mol
Molecular Formula C12H11N5
Exact Mass 225.101445 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7Ec65X20vlP
Name 4-[(E)-(4,5-dimethyl-1,2,3-triazol-1-yl)iminomethyl]benzenecarbonitrile
Alternate Name(s) Benzonitrile, 4-[[(4,5-dimethyl-1H-1,2,3-triazol-1-yl)imino]methyl]- 4-((E)-[(4,5-Dimethyl-1H-1,2,3-triazol-1-yl)imino]methyl)benzonitrile 4-[(E)-(4,5-dimethyl-1-triazolyl)iminomethyl]benzonitrile 4-[(E)-(4,5-dimethyltriazol-1-yl)iminomethyl]benzonitrile
CAS Registry Number 113261-32-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H11N5
InChI InChI=1S/C12H11N5/c1-9-10(2)17(16-15-9)14-8-12-5-3-11(7-13)4-6-12/h3-6,8H,1-2H3/b14-8+
InChIKey CWAAYHDYXUUGPG-RIYZIHGNSA-N
Molecular Weight 225.255 g/mol
SMILES Cc1c(C)[n](\N=C\c2ccc(cc2)C#N)nn1
SPLASH splash10-0gb9-9800000000-d4b33545008afb08d07e
Source of Spectrum Y-24-1465-16
Wiley ID 1226359