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[5-methyl-2-(4-nitrophenyl)-3-oxidanidyl-1,2,3-triazol-3-ium-4-yl]-phenyl-methanone
SpectraBase Compound ID 3gazKqkJNsE
InChI InChI=1S/C16H12N4O4/c1-11-15(16(21)12-5-3-2-4-6-12)19(22)18(17-11)13-7-9-14(10-8-13)20(23)24/h2-10H,1H3
InChIKey MZUVOMJKXHFYAX-UHFFFAOYSA-N
Mol Weight 324.3 g/mol
Molecular Formula C16H12N4O4
Exact Mass 324.085855 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BFrj4isWejp
Name [5-methyl-2-(4-nitrophenyl)-3-oxidanidyl-1,2,3-triazol-3-ium-4-yl]-phenyl-methanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H12N4O4
InChI InChI=1S/C16H12N4O4/c1-11-15(16(21)12-5-3-2-4-6-12)19(22)18(17-11)13-7-9-14(10-8-13)20(23)24/h2-10H,1H3
InChIKey MZUVOMJKXHFYAX-UHFFFAOYSA-N
Molecular Weight 324.296 g/mol
SMILES c1(n[n]([n+](c1C(=O)c1ccccc1)[O-])-c1ccc(N(=O)=O)cc1)C
SPLASH splash10-0096-9701000000-66b0d0fc76a0067d16cd
Source of Spectrum Y-33-658-5
Synonyms [5-methyl-2-(4-nitrophenyl)-3-oxido-4-triazol-3-iumyl]-phenylmethanone [5-methyl-2-(4-nitrophenyl)-3-oxido-triazol-3-ium-4-yl]-phenyl-methanone
Wiley ID 1322974