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3-[6-(4-chlorophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-3-yl]-5-methyl-1,2-oxazole
SpectraBase Compound ID CUbnuEdrkHP
InChI InChI=1S/C14H10ClN5OS/c1-8-6-11(19-21-8)13-16-17-14-20(13)18-12(7-22-14)9-2-4-10(15)5-3-9/h2-6H,7H2,1H3
InChIKey SWPXLMQYTQPJAQ-UHFFFAOYSA-N
Mol Weight 331.78 g/mol
Molecular Formula C14H10ClN5OS
Exact Mass 331.029459 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID alxXyzDjor
Name 3-[6-(4-chlorophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-3-yl]-5-methyl-1,2-oxazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H10ClN5OS
InChI InChI=1S/C14H10ClN5OS/c1-8-6-11(19-21-8)13-16-17-14-20(13)18-12(7-22-14)9-2-4-10(15)5-3-9/h2-6H,7H2,1H3
InChIKey SWPXLMQYTQPJAQ-UHFFFAOYSA-N
Literature Reference DOI 10.1002/cjoc.20010191015
Molecular Weight 331.781 g/mol
SMILES c1(noc(C)c1)-c1nnc2SCC(=N[n]12)c1ccc(cc1)Cl
SPLASH splash10-001i-1609000000-6db1abad196cd7872412
Source of Spectrum CJC-19-995-9
Synonyms 3-(5-Methylisoxazol-3-yl)-6-(4-chlorophenyl)-7H-1,2,4-triazolo[3,4-b]-1,3,4-thiadiazine 3-[6-(4-chlorophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-3-yl]-5-methyl-isoxazole 3-(6-(4-chlorophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-3-yl)-5-methylisoxazole 3-[6-(4-chlorophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-3-yl]-5-methylisoxazole
Wiley ID 1773514