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[2-(4-chlorophenyl)-5-methyl-3-oxidanidyl-1,2,3-triazol-3-ium-4-yl]-phenyl-methanone
SpectraBase Compound ID 1ZHprAQoRpW
InChI InChI=1S/C16H12ClN3O2/c1-11-15(16(21)12-5-3-2-4-6-12)20(22)19(18-11)14-9-7-13(17)8-10-14/h2-10H,1H3
InChIKey NWXASXFQXRAJPP-UHFFFAOYSA-N
Mol Weight 313.74 g/mol
Molecular Formula C16H12ClN3O2
Exact Mass 313.061804 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CcXG9LJeZgY
Name [2-(4-chlorophenyl)-5-methyl-3-oxidanidyl-1,2,3-triazol-3-ium-4-yl]-phenyl-methanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H12ClN3O2
InChI InChI=1S/C16H12ClN3O2/c1-11-15(16(21)12-5-3-2-4-6-12)20(22)19(18-11)14-9-7-13(17)8-10-14/h2-10H,1H3
InChIKey NWXASXFQXRAJPP-UHFFFAOYSA-N
Molecular Weight 313.744 g/mol
SMILES c1(n[n]([n+](c1C(=O)c1ccccc1)[O-])-c1ccc(cc1)Cl)C
SPLASH splash10-08i0-3819000000-30ba0a2c56e215ca96e5
Source of Spectrum Y-33-658-5
Synonyms [2-(4-chlorophenyl)-5-methyl-3-oxido-4-triazol-3-iumyl]-phenylmethanone [2-(4-chlorophenyl)-5-methyl-3-oxido-triazol-3-ium-4-yl]-phenyl-methanone
Wiley ID 1314155