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3H-1,2,4-Triazolo[4,3-b][1,2,4]triazol-3-one, 2,7-dihydro-2-methyl-7-phenyl-6-(phenylamino)-
SpectraBase Compound ID FTpE4qC9Ypl
InChI InChI=1S/C16H14N6O/c1-20-16(23)22-15(19-20)21(13-10-6-3-7-11-13)14(18-22)17-12-8-4-2-5-9-12/h2-11H,1H3,(H,17,18)
InChIKey WVIIEDWZVBWVBM-UHFFFAOYSA-N
Mol Weight 306.33 g/mol
Molecular Formula C16H14N6O
Exact Mass 306.122909 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IhFS4iGhi4S
Name 3H-1,2,4-Triazolo[4,3-b][1,2,4]triazol-3-one, 2,7-dihydro-2-methyl-7-phenyl-6-(phenylamino)-
CAS Registry Number 116088-27-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H14N6O
InChI InChI=1S/C16H14N6O/c1-20-16(23)22-15(19-20)21(13-10-6-3-7-11-13)14(18-22)17-12-8-4-2-5-9-12/h2-11H,1H3,(H,17,18)
InChIKey WVIIEDWZVBWVBM-UHFFFAOYSA-N
Molecular Weight 306.329 g/mol
SMILES N(C1=NN2C(N1c1ccccc1)=NN(C2=O)C)c1ccccc1
SPLASH splash10-0a4i-2539000000-669644d2f3309bc109c0
Source of Spectrum KC-1987-2670-11
Synonyms 2-Methyl-7-phenyl-6-phenylamino-7H-1,2,4-triazolo[4,3-b][1,2,4]triazol-3(2H)-one 6-Anilino-2-methyl-7-phenyl-2,7-dihydro-3H-[1,2,4]triazolo[4,3-b][1,2,4]triazol-3-one
Wiley ID 1307902