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3-Quinolinecarboxylic acid, 6,8-difluoro-4-hydroxy-, ethyl ester
SpectraBase Compound ID 36eV55K818t
InChI InChI=1S/C12H9F2NO3/c1-2-18-12(17)8-5-15-10-7(11(8)16)3-6(13)4-9(10)14/h3-5H,2H2,1H3,(H,15,16)
InChIKey NUHKASXLPYOGHW-UHFFFAOYSA-N
Mol Weight 253.2 g/mol
Molecular Formula C12H9F2NO3
Exact Mass 253.055049 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CpdExEV6YA4
Name 3-Quinolinecarboxylic acid, 6,8-difluoro-4-hydroxy-, ethyl ester
Alternate Name(s) Ethyl 6,8-difluoro-4-hydroxyquinoline-3-carboxylate 6,8-Difluoro-4-oxo-1H-quinoline-3-carboxylic acid ethyl ester Ethyl 6,8-difluoro-4-oxo-1H-quinoline-3-carboxylate Ethyl 6,8-bis(fluoranyl)-4-oxidanylidene-1H-quinoline-3-carboxylate
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Formula C12H9F2NO3
InChI InChI=1S/C12H9F2NO3/c1-2-18-12(17)8-5-15-10-7(11(8)16)3-6(13)4-9(10)14/h3-5H,2H2,1H3,(H,15,16)
InChIKey NUHKASXLPYOGHW-UHFFFAOYSA-N
Molecular Weight 253.205 g/mol
SMILES Oc1c(C(=O)OCC)cnc2c1cc(cc2F)F
SPLASH splash10-0a4i-3790000000-f29ca531129d4eee1719
Source of Spectrum IY-2-4899-3
Wiley ID 1656976