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3H-1,2,4-Triazolo[4,3-b][1,2,4]triazol-3-one, 1,2-dihydro-6-(4-methoxyphenyl)-2-methyl-
SpectraBase Compound ID 581nQUPhfRZ
InChI InChI=1S/C11H11N5O2/c1-15-11(17)16-10(14-15)12-9(13-16)7-3-5-8(18-2)6-4-7/h3-6H,1-2H3,(H,12,13,14)
InChIKey PFLVGELRWRSYAC-UHFFFAOYSA-N
Mol Weight 245.24 g/mol
Molecular Formula C11H11N5O2
Exact Mass 245.091275 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ChfgJAnTPxf
Name 3H-1,2,4-Triazolo[4,3-b][1,2,4]triazol-3-one, 1,2-dihydro-6-(4-methoxyphenyl)-2-methyl-
CAS Registry Number 96906-85-3
Comments Less than 3 mono-isotopic peaks
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Formula C11H11N5O2
InChI InChI=1S/C11H11N5O2/c1-15-11(17)16-10(14-15)12-9(13-16)7-3-5-8(18-2)6-4-7/h3-6H,1-2H3,(H,12,13,14)
InChIKey PFLVGELRWRSYAC-UHFFFAOYSA-N
Molecular Weight 245.242 g/mol
SMILES N1C(=NN2C1=NN(C2=O)C)c1ccc(cc1)OC
SPLASH splash10-000t-0690000000-04a1ee0af20b803ecf8b
Source of Spectrum AJ-58-741-4
Synonyms 2-Methyl-6-(4-methoxyphenyl)-7H-1,2,4-triazolo[4,3-b][1,2,4]triazol-3-(2H)-one 6-(4-methoxyphenyl)-2-methyl-2,7-dihydro-3H-[1,2,4]triazolo[4,3-b][1,2,4]triazol-3-one
Wiley ID 1247805