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2-[(6-methyl-7H-pyrazolo[5,1-c][1,2,4]triazol-3-yl)methyl]-4-(3,4-dimethylphenyl)phthalazin-1(2H)-one
SpectraBase Compound ID EeVwO1YMYjZ
InChI InChI=1S/C22H20N6O/c1-13-8-9-16(10-14(13)2)21-17-6-4-5-7-18(17)22(29)27(26-21)12-20-24-23-19-11-15(3)25-28(19)20/h4-10H,11-12H2,1-3H3
InChIKey PIRCRAAFZUMWKV-UHFFFAOYSA-N
Mol Weight 384.44 g/mol
Molecular Formula C22H20N6O
Exact Mass 384.169859 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8oXvALcm7wJ
Name 2-[(6-methyl-7H-pyrazolo[5,1-c][1,2,4]triazol-3-yl)methyl]-4-(3,4-dimethylphenyl)phthalazin-1(2H)-one
Comments Less than 3 mono-isotopic peaks
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Formula C22H20N6O
InChI InChI=1S/C22H20N6O/c1-13-8-9-16(10-14(13)2)21-17-6-4-5-7-18(17)22(29)27(26-21)12-20-24-23-19-11-15(3)25-28(19)20/h4-10H,11-12H2,1-3H3
InChIKey PIRCRAAFZUMWKV-UHFFFAOYSA-N
Molecular Weight 384.443 g/mol
SMILES c1([n]2c(nn1)CC(=N2)C)CN1N=C(c2cc(C)c(cc2)C)c2c(C1=O)cccc2
SPLASH splash10-0f6t-0090000000-34fb1fd5d7b6e20eda98
Source of Spectrum F2-45-1276-23
Synonyms 4-(3,4-dimethylphenyl)-2-[(6-methyl-7H-pyrazolo[5,1-c][1,2,4]triazol-3-yl)methyl]-1-phthalazinone
Wiley ID 1689263