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6-(4-Bromophenyl)-2-phenyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridin-3(2H)-one
SpectraBase Compound ID 3oARkOILY1g
InChI InChI=1S/C19H11BrF3N3O/c20-12-8-6-11(7-9-12)15-10-14(19(21,22)23)16-17(24-15)25-26(18(16)27)13-4-2-1-3-5-13/h1-10H,(H,24,25)
InChIKey FQVZSJIEQRWPHN-UHFFFAOYSA-N
Mol Weight 434.22 g/mol
Molecular Formula C19H11BrF3N3O
Exact Mass 433.003759 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KqoLnwI2ETY
Name 6-(4-Bromophenyl)-2-phenyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridin-3(2H)-one
Appearance Green crystals
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Exact Mass 433.003759474 u
Formula C19H11BrF3N3O
InChI InChI=1S/C19H11BrF3N3O/c20-12-8-6-11(7-9-12)15-10-14(19(21,22)23)16-17(24-15)25-26(18(16)27)13-4-2-1-3-5-13/h1-10H,(H,24,25)
InChIKey FQVZSJIEQRWPHN-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.201800163
Molecular Weight 434.216 g/mol
Quality 373
Reported Formula C19H12BrF3N3O
SMILES N1C2=NC(=CC(=C2C(N1C1=CC=CC=C1)=O)C(F)(F)F)C1=CC=C(C=C1)Br
SPLASH splash10-0040-3000900000-194c4cccdb04b8a79ef8
Source of Spectrum K1-2018-2641-2x (DOI: 10.1002/ejoc.201800163)
Wiley ID 1891671