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4-{[6,7-Dimethoxy-4-(trifluoromethyl)quinolin-2-yl]amino}benzoic acid
SpectraBase Compound ID GJ1xMGO1WOW
InChI InChI=1S/C19H15F3N2O4/c1-27-15-7-12-13(19(20,21)22)8-17(24-14(12)9-16(15)28-2)23-11-5-3-10(4-6-11)18(25)26/h3-9H,1-2H3,(H,23,24)(H,25,26)
InChIKey PZEJNUYYLQCXMD-UHFFFAOYSA-N
Mol Weight 392.33 g/mol
Molecular Formula C19H15F3N2O4
Exact Mass 392.098391 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B2HdG8CzsS8
Name 4-{[6,7-Dimethoxy-4-(trifluoromethyl)quinolin-2-yl]amino}benzoic acid
Alternate Name(s) 4-[[6,7-dimethoxy-4-(trifluoromethyl)-2-quinolinyl]amino]benzoic acid 4-[[6,7-dimethoxy-4-(trifluoromethyl)quinolin-2-yl]amino]benzoic acid
Comments Less than 3 mono-isotopic peaks
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Formula C19H15F3N2O4
InChI InChI=1S/C19H15F3N2O4/c1-27-15-7-12-13(19(20,21)22)8-17(24-14(12)9-16(15)28-2)23-11-5-3-10(4-6-11)18(25)26/h3-9H,1-2H3,(H,23,24)(H,25,26)
InChIKey PZEJNUYYLQCXMD-UHFFFAOYSA-N
Molecular Weight 392.334 g/mol
SMILES N(c1nc2c(c(C(F)(F)F)c1)cc(c(OC)c2)OC)c1ccc(C(=O)O)cc1
SPLASH splash10-0006-0009000000-7a7b2ab5b5d5f337b869
Source of Spectrum Y-46-419-9
Wiley ID 1666740