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(Z)-N-[4,5-dimethyl-2-(4-nitrophenyl)-1,2,3-triazol-1-ium-1-yl]benzenecarboximidate

View entire compound with spectra: 1 MS (GC)

(Z)-N-[4,5-dimethyl-2-(4-nitrophenyl)-1,2,3-triazol-1-ium-1-yl]benzenecarboximidate
SpectraBase Compound ID 13Px8vf0MyW
InChI InChI=1S/C17H15N5O3/c1-12-13(2)20(19-17(23)14-6-4-3-5-7-14)21(18-12)15-8-10-16(11-9-15)22(24)25/h3-11H,1-2H3
InChIKey PBXDRVLLOOCWIE-UHFFFAOYSA-N
Mol Weight 337.34 g/mol
Molecular Formula C17H15N5O3
Exact Mass 337.117489 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I8LGW3dPjdf
Name (Z)-N-[4,5-dimethyl-2-(4-nitrophenyl)-1,2,3-triazol-1-ium-1-yl]benzenecarboximidate
CAS Registry Number 138815-33-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H15N5O3
InChI InChI=1S/C17H15N5O3/c1-12-13(2)20(19-17(23)14-6-4-3-5-7-14)21(18-12)15-8-10-16(11-9-15)22(24)25/h3-11H,1-2H3
InChIKey PBXDRVLLOOCWIE-UHFFFAOYSA-N
Molecular Weight 337.339 g/mol
SMILES c1(n[n]([n+](c1C)[N-]C(=O)c1ccccc1)-c1ccc(N(=O)=O)cc1)C
SPLASH splash10-0aor-0920000000-d3fda0f00ff16e95eead
Source of Spectrum J-57-2257-9
Synonyms (Z)-N-[4,5-dimethyl-2-(4-nitrophenyl)-1-triazol-1-iumyl]benzenecarboximidate (Z)-N-[4,5-dimethyl-2-(4-nitrophenyl)triazol-1-ium-1-yl]benzenecarboximidate
Wiley ID 1333006