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2-(2-((5,7-dibromoquinolin-8-yl)oxy)acetyl)-5-methyl-1,2-dihydro-3H-pyrazol-3-one
SpectraBase Compound ID 7FErYE7Uf8s
InChI InChI=1S/C15H11Br2N3O3/c1-8-5-12(21)20(19-8)13(22)7-23-15-11(17)6-10(16)9-3-2-4-18-14(9)15/h2-6,19H,7H2,1H3
InChIKey XKKOSMTWVKFDAK-UHFFFAOYSA-N
Mol Weight 441.08 g/mol
Molecular Formula C15H11Br2N3O3
Exact Mass 438.916717 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1HqddaJjOMB
Name 2-(2-((5,7-dibromoquinolin-8-yl)oxy)acetyl)-5-methyl-1,2-dihydro-3H-pyrazol-3-one
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Formula C15H11Br2N3O3
InChI InChI=1S/C15H11Br2N3O3/c1-8-5-12(21)20(19-8)13(22)7-23-15-11(17)6-10(16)9-3-2-4-18-14(9)15/h2-6,19H,7H2,1H3
InChIKey XKKOSMTWVKFDAK-UHFFFAOYSA-N
Molecular Weight 441.079 g/mol
SMILES N1C(=CC(N1C(=O)COc1c(cc(c2cccnc12)Br)Br)=O)C
SPLASH splash10-0aor-0295000000-d317dc28fc9ec69864da
Source of Spectrum Reem K. Arafa, et al. European Journal of Medicinal Chemistry, V.63, 2013, P.826-832
Wiley ID 1816872