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3H-1,2,4-Triazolo[4,3-b][1,2,4]triazole-3-thione, 1,2-dihydro-6-(4-methoxyphenyl)-2-methyl-
SpectraBase Compound ID DSKFvqLLiVl
InChI InChI=1S/C11H11N5OS/c1-15-11(18)16-10(14-15)12-9(13-16)7-3-5-8(17-2)6-4-7/h3-6H,1-2H3,(H,12,13,14)
InChIKey DCIKUQPXZGWCGJ-UHFFFAOYSA-N
Mol Weight 261.3 g/mol
Molecular Formula C11H11N5OS
Exact Mass 261.068431 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID COL4qCiFCmB
Name 3H-1,2,4-Triazolo[4,3-b][1,2,4]triazole-3-thione, 1,2-dihydro-6-(4-methoxyphenyl)-2-methyl-
Alternate Name(s) 2-Methyl-6-(4-methoxyphenyl)-2-methyl-7H-1,2,4-triazolo[4,3-b][1,2,4]triazol-3(2H)-one 6-(4-Methoxyphenyl)-2-methyl-1,2-dihydro-3H-[1,2,4]triazolo[4,3-b][1,2,4]triazole-3-thione
CAS Registry Number 97199-79-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H11N5OS
InChI InChI=1S/C11H11N5OS/c1-15-11(18)16-10(14-15)12-9(13-16)7-3-5-8(17-2)6-4-7/h3-6H,1-2H3,(H,12,13,14)
InChIKey DCIKUQPXZGWCGJ-UHFFFAOYSA-N
Molecular Weight 261.303 g/mol
SMILES N1N(C([n]2c1nc(n2)-c1ccc(cc1)OC)=S)C
SPLASH splash10-03di-0290000000-27513bbfe1c08fb0725d
Source of Spectrum AJ-58-741-9
Wiley ID 1264539