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(5-methyl-3-oxidanidyl-2-phenyl-1,2,3-triazol-3-ium-4-yl)-phenyl-methanone
SpectraBase Compound ID JNrtXBvfMW7
InChI InChI=1S/C16H13N3O2/c1-12-15(16(20)13-8-4-2-5-9-13)19(21)18(17-12)14-10-6-3-7-11-14/h2-11H,1H3
InChIKey HUBWPEGRAFLWPI-UHFFFAOYSA-N
Mol Weight 279.3 g/mol
Molecular Formula C16H13N3O2
Exact Mass 279.100777 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EGizoR4oykR
Name (5-methyl-3-oxidanidyl-2-phenyl-1,2,3-triazol-3-ium-4-yl)-phenyl-methanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H13N3O2
InChI InChI=1S/C16H13N3O2/c1-12-15(16(20)13-8-4-2-5-9-13)19(21)18(17-12)14-10-6-3-7-11-14/h2-11H,1H3
InChIKey HUBWPEGRAFLWPI-UHFFFAOYSA-N
Molecular Weight 279.299 g/mol
SMILES c1(n[n]([n+](c1C(=O)c1ccccc1)[O-])-c1ccccc1)C
SPLASH splash10-056r-9620000000-d8a49cbf3367609b7bc6
Source of Spectrum Y-33-657-5
Synonyms (5-methyl-3-oxido-2-phenyl-4-triazol-3-iumyl)-phenylmethanone (5-methyl-3-oxido-2-phenyl-triazol-3-ium-4-yl)-phenyl-methanone
Wiley ID 1283016