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[1,2,4]Triazolo[5,1-c][1,2,4]triazin-4(8H)-one, 8-(4-chlorophenyl)-3-methyl-7-(4-methylphenyl)-
SpectraBase Compound ID 22hrNtUIiCO
InChI InChI=1S/C18H14ClN5O/c1-11-3-5-13(6-4-11)16-22-24-17(25)12(2)20-21-18(24)23(16)15-9-7-14(19)8-10-15/h3-10H,1-2H3
InChIKey AMKIUQRHQQGXBO-UHFFFAOYSA-N
Mol Weight 351.8 g/mol
Molecular Formula C18H14ClN5O
Exact Mass 351.088688 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2eAi5lfNeMr
Name [1,2,4]Triazolo[5,1-c][1,2,4]triazin-4(8H)-one, 8-(4-chlorophenyl)-3-methyl-7-(4-methylphenyl)-
CAS Registry Number 109107-10-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H14ClN5O
InChI InChI=1S/C18H14ClN5O/c1-11-3-5-13(6-4-11)16-22-24-17(25)12(2)20-21-18(24)23(16)15-9-7-14(19)8-10-15/h3-10H,1-2H3
InChIKey AMKIUQRHQQGXBO-UHFFFAOYSA-N
Molecular Weight 351.797 g/mol
SMILES C=12N(N=C(N2c2ccc(cc2)Cl)c2ccc(cc2)C)C(C(=NN1)C)=O
SPLASH splash10-0udi-0539000000-a7b485e6890262422357
Source of Spectrum KC-1986-2046-30
Synonyms 7-(p-tolyl)-8-(4-chlorophenyl)-3-methyl[1,2,4]triazolo[5,1-c][1,2,4]triazin-4(8H)-one 8-(4-Chlorophenyl)-3-methyl-7-(4-methylphenyl)[1,2,4]triazolo[5,1-c][1,2,4]triazin-4(8H)-one
Wiley ID 1342534