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5H-[1,2,4]Triazolo[3,4-b][1,3]thiazin-5-one, 7-(4-chlorophenyl)-3-methyl-
SpectraBase Compound ID D3s3sedrXP6
InChI InChI=1S/C12H8ClN3OS/c1-7-14-15-12-16(7)11(17)6-10(18-12)8-2-4-9(13)5-3-8/h2-6H,1H3
InChIKey VDTQQLUHZFSIIR-UHFFFAOYSA-N
Mol Weight 277.73 g/mol
Molecular Formula C12H8ClN3OS
Exact Mass 277.007661 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CPH22wdInIZ
Name 5H-[1,2,4]Triazolo[3,4-b][1,3]thiazin-5-one, 7-(4-chlorophenyl)-3-methyl-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H8ClN3OS
InChI InChI=1S/C12H8ClN3OS/c1-7-14-15-12-16(7)11(17)6-10(18-12)8-2-4-9(13)5-3-8/h2-6H,1H3
InChIKey VDTQQLUHZFSIIR-UHFFFAOYSA-N
Molecular Weight 277.729 g/mol
SMILES C1(=O)[n]2c(nnc2SC(c2ccc(cc2)Cl)=C1)C
SPLASH splash10-004i-3890000000-7c03f48705c5d6069918
Source of Spectrum IY-2-4726-6
Synonyms 7-(4-Chlorophenyl)-3-methyl-5H-[1,2,4]triazolo[3,4-b][1,3]thiazin-5-one
Wiley ID 1655249