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2-((5,7-dibromoquinolin-8-yl)oxy)-1-(3,5-dimethyl-1H-pyrazol-1-yl)ethan-1-one
SpectraBase Compound ID 7kjkCEFqd8
InChI InChI=1S/C16H13Br2N3O2/c1-9-6-10(2)21(20-9)14(22)8-23-16-13(18)7-12(17)11-4-3-5-19-15(11)16/h3-7H,8H2,1-2H3
InChIKey OQLLNPZEHLXIMB-UHFFFAOYSA-N
Mol Weight 439.11 g/mol
Molecular Formula C16H13Br2N3O2
Exact Mass 436.937453 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2KKwmmmYuTA
Name 2-((5,7-dibromoquinolin-8-yl)oxy)-1-(3,5-dimethyl-1H-pyrazol-1-yl)ethan-1-one
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Formula C16H13Br2N3O2
InChI InChI=1S/C16H13Br2N3O2/c1-9-6-10(2)21(20-9)14(22)8-23-16-13(18)7-12(17)11-4-3-5-19-15(11)16/h3-7H,8H2,1-2H3
InChIKey OQLLNPZEHLXIMB-UHFFFAOYSA-N
Molecular Weight 439.107 g/mol
SMILES C(COc1c(cc(c2cccnc12)Br)Br)([n]1nc(cc1C)C)=O
SPLASH splash10-0uk9-7957200000-e0ceb4406aaf98dbca6c
Source of Spectrum Reem K. Arafa, et al. European Journal of Medicinal Chemistry, V.63, 2013, P.826-832
Wiley ID 1816871