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3H-1,2,4-Triazolo[4,3-b][1,2,4]triazol-3-one, 6-(4-chlorophenyl)-1,2-dihydro-2-methyl-
SpectraBase Compound ID 18iKSqjX8Ha
InChI InChI=1S/C10H8ClN5O/c1-15-10(17)16-9(14-15)12-8(13-16)6-2-4-7(11)5-3-6/h2-5H,1H3,(H,12,13,14)
InChIKey HJZPTWFZGPSTQC-UHFFFAOYSA-N
Mol Weight 249.66 g/mol
Molecular Formula C10H8ClN5O
Exact Mass 249.041738 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6iXRxMY3HTJ
Name 3H-1,2,4-Triazolo[4,3-b][1,2,4]triazol-3-one, 6-(4-chlorophenyl)-1,2-dihydro-2-methyl-
Alternate Name(s) 2-Methyl-6-(4-chlorophenyl)-7H-1,2,4-triazolo[4,3-b][1,2,4]triazol-3-(2H)-one 6-(4-Chlorophenyl)-2-methyl-2,7-dihydro-3H-[1,2,4]triazolo[4,3-b][1,2,4]triazol-3-one
CAS Registry Number 96906-84-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H8ClN5O
InChI InChI=1S/C10H8ClN5O/c1-15-10(17)16-9(14-15)12-8(13-16)6-2-4-7(11)5-3-6/h2-5H,1H3,(H,12,13,14)
InChIKey HJZPTWFZGPSTQC-UHFFFAOYSA-N
Molecular Weight 249.661 g/mol
SMILES N1C(=NN2C1=NN(C2=O)C)c1ccc(cc1)Cl
SPLASH splash10-000j-0690000000-d57f7d4fa8b730fffa8f
Source of Spectrum AJ-58-741-4
Wiley ID 1251934