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5-Methyl-3-[6-(4-methylphenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-3-yl]-1,2-oxazole
SpectraBase Compound ID C5HusP6NXK7
InChI InChI=1S/C15H13N5OS/c1-9-3-5-11(6-4-9)13-8-22-15-17-16-14(20(15)18-13)12-7-10(2)21-19-12/h3-7H,8H2,1-2H3
InChIKey CXOBRPIFVITYII-UHFFFAOYSA-N
Mol Weight 311.36 g/mol
Molecular Formula C15H13N5OS
Exact Mass 311.084081 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7rKI0DU6JSX
Name 5-Methyl-3-[6-(4-methylphenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-3-yl]-1,2-oxazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H13N5OS
InChI InChI=1S/C15H13N5OS/c1-9-3-5-11(6-4-9)13-8-22-15-17-16-14(20(15)18-13)12-7-10(2)21-19-12/h3-7H,8H2,1-2H3
InChIKey CXOBRPIFVITYII-UHFFFAOYSA-N
Literature Reference DOI 10.1002/cjoc.20010191015
Molecular Weight 311.363 g/mol
SMILES c1(noc(C)c1)-c1nnc2SCC(=N[n]12)c1ccc(cc1)C
SPLASH splash10-03dl-3709000000-b9f68d3b413db21e564e
Source of Spectrum CJC-19-995-8
Synonyms 3-(5-Methylisoxazol-3-yl)-6-(4-methylphenyl)-7H-1,2,4-triazolo[3,4-b]-1,3,4-thiadiazine 5-Methyl-3-[6-(4-methylphenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-3-yl]isoxazole 5-Methyl-3-[6-(p-tolyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-3-yl]isoxazole 5-Methyl-3-(6-(p-tolyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-3-yl)isoxazole
Wiley ID 1773513