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4-keto-N-(4-methoxyphenyl)-1H-[1,2,4]triazino[4,3-a]benzimidazole-3-carboxamide
SpectraBase Compound ID HYeBwENY5VW
InChI InChI=1S/C17H13N5O3/c1-25-11-8-6-10(7-9-11)18-15(23)14-16(24)22-13-5-3-2-4-12(13)19-17(22)21-20-14/h2-9H,1H3,(H,18,23)(H,19,21)
InChIKey RMMCXZRHKSTJRC-UHFFFAOYSA-N
Mol Weight 335.32 g/mol
Molecular Formula C17H13N5O3
Exact Mass 335.101839 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K4BRFXOcxpt
Name 4-keto-N-(4-methoxyphenyl)-1H-[1,2,4]triazino[4,3-a]benzimidazole-3-carboxamide
Alternate Name(s) N-(4-methoxyphenyl)-4-oxidanylidene-1H-[1,2,4]triazino[4,3-a]benzimidazole-3-carboxamide N-(4-methoxyphenyl)-4-oxo-1H-[1,2,4]triazino[4,3-a]benzimidazole-3-carboxamide
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H13N5O3
InChI InChI=1S/C17H13N5O3/c1-25-11-8-6-10(7-9-11)18-15(23)14-16(24)22-13-5-3-2-4-12(13)19-17(22)21-20-14/h2-9H,1H3,(H,18,23)(H,19,21)
InChIKey RMMCXZRHKSTJRC-UHFFFAOYSA-N
Molecular Weight 335.323 g/mol
SMILES N(C(C=1C(N2C(=NN1)Nc1c2cccc1)=O)=O)c1ccc(cc1)OC
SPLASH splash10-00di-0900000000-721234dff659752d8da1
Source of Spectrum D9-336-417-6
Wiley ID 1551056