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3-Methylthio-6-(4-methylphenyl)-1H-s-triazolo[4,3-b]-s-triazole
SpectraBase Compound ID 1XulrJ3vTjL
InChI InChI=1S/C11H11N5S/c1-7-3-5-8(6-4-7)9-12-10-13-14-11(17-2)16(10)15-9/h3-6H,1-2H3,(H,12,13,15)
InChIKey JOSRCLHEFWVXKK-UHFFFAOYSA-N
Mol Weight 245.3 g/mol
Molecular Formula C11H11N5S
Exact Mass 245.073517 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JfjMBSWMhx8
Name 3-Methylthio-6-(4-methylphenyl)-1H-s-triazolo[4,3-b]-s-triazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H11N5S
InChI InChI=1S/C11H11N5S/c1-7-3-5-8(6-4-7)9-12-10-13-14-11(17-2)16(10)15-9/h3-6H,1-2H3,(H,12,13,15)
InChIKey JOSRCLHEFWVXKK-UHFFFAOYSA-N
Molecular Weight 245.304 g/mol
SMILES N1N=C([n]2c1nc(n2)-c1ccc(cc1)C)SC
SPLASH splash10-0005-3790000000-ddd069ec684c1db3a3f3
Source of Spectrum SO-0-416-4
Synonyms 6-(4-Methylphenyl)-3-(methylsulfanyl)-1H-[1,2,4]triazolo[4,3-b][1,2,4]triazole Methyl 6-(4-methylphenyl)-1H-[1,2,4]triazolo[4,3-b][1,2,4]triazol-3-yl sulfide
Wiley ID 1537919