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6-(Furan-2-yl)-2-phenyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]-pyridin-3(2H)-one
SpectraBase Compound ID eZHxlISurV
InChI InChI=1S/C17H10F3N3O2/c18-17(19,20)11-9-12(13-7-4-8-25-13)21-15-14(11)16(24)23(22-15)10-5-2-1-3-6-10/h1-9H,(H,21,22)
InChIKey WNPKGGKNEKAHCT-UHFFFAOYSA-N
Mol Weight 345.28 g/mol
Molecular Formula C17H10F3N3O2
Exact Mass 345.072511 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8TMEbrbhaWi
Name 6-(Furan-2-yl)-2-phenyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]-pyridin-3(2H)-one
Appearance Yellow crystals
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Exact Mass 345.072511061 u
Formula C17H10F3N3O2
InChI InChI=1S/C17H10F3N3O2/c18-17(19,20)11-9-12(13-7-4-8-25-13)21-15-14(11)16(24)23(22-15)10-5-2-1-3-6-10/h1-9H,(H,21,22)
InChIKey WNPKGGKNEKAHCT-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.201800163
Molecular Weight 345.281 g/mol
Quality 204
Reported Formula C17H10F3N3O2
SMILES N1N(C(C=2C1=NC(=CC2C(F)(F)F)C=1OC=CC1)=O)C1=CC=CC=C1
SPLASH splash10-0002-1009000000-9c7d6531a7656befe186
Source of Spectrum K1-2018-2639-2i (DOI: 10.1002/ejoc.201800163)
Wiley ID 1891658