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3-(2,6-Dichloro-phenyl)-5-methyl-isoxazole-4-carboxylic acid (1H-[1,2,4]triazol-3-yl)-amide
SpectraBase Compound ID 5UbCmfcTZ8U
InChI InChI=1S/C13H9Cl2N5O2/c1-6-9(12(21)18-13-16-5-17-19-13)11(20-22-6)10-7(14)3-2-4-8(10)15/h2-5H,1H3,(H2,16,17,18,19,21)
InChIKey VJVFJKNIJSFLIO-UHFFFAOYSA-N
Mol Weight 338.15 g/mol
Molecular Formula C13H9Cl2N5O2
Exact Mass 337.01333 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Hms1TZHWAgf
Name 3-(2,6-Dichloro-phenyl)-5-methyl-isoxazole-4-carboxylic acid (1H-[1,2,4]triazol-3-yl)-amide
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Formula C13H9Cl2N5O2
InChI InChI=1S/C13H9Cl2N5O2/c1-6-9(12(21)18-13-16-5-17-19-13)11(20-22-6)10-7(14)3-2-4-8(10)15/h2-5H,1H3,(H2,16,17,18,19,21)
InChIKey VJVFJKNIJSFLIO-UHFFFAOYSA-N
Molecular Weight 338.154 g/mol
SMILES N(C(c1c(noc1C)-c1c(cccc1Cl)Cl)=O)c1nc[nH]n1
SPLASH splash10-0ikc-7396000000-fdd4cc4db36253db5684
Synonyms 3-(2,6-Dichlorophenyl)-5-methyl-N-(1H-1,2,4-triazol-3-yl)-4-isoxazolecarboxamide 3-(2,6-dichlorophenyl)-5-methyl-N-(1H-1,2,4-triazol-5-yl)-1,2-oxazole-4-carboxamide 3-(2,6-dichlorophenyl)-5-methyl-N-(1H-1,2,4-triazol-5-yl)-4-isoxazolecarboxamide 3-(2,6-dichlorophenyl)-5-methyl-N-(1H-1,2,4-triazol-5-yl)isoxazole-4-carboxamide 3-[2,6-bis(chloranyl)phenyl]-5-methyl-N-(1H-1,2,4-triazol-5-yl)-1,2-oxazole-4-carboxamide
Wiley ID 1463170