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2-(8-amino-5-quinolinyl)-3,3,3-trifluoro-2-hydroxypropanoic acid methyl ester
SpectraBase Compound ID 48DwUU4Ultd
InChI InChI=1S/C13H11F3N2O3/c1-21-11(19)12(20,13(14,15)16)8-4-5-9(17)10-7(8)3-2-6-18-10/h2-6,20H,17H2,1H3
InChIKey KJWQDDIXCXBRAH-UHFFFAOYSA-N
Mol Weight 300.24 g/mol
Molecular Formula C13H11F3N2O3
Exact Mass 300.072177 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8m9diJz9Foc
Name 2-(8-amino-5-quinolinyl)-3,3,3-trifluoro-2-hydroxypropanoic acid methyl ester
Alternate Name(s) 2-(8-amino-5-quinolyl)-3,3,3-trifluoro-2-hydroxy-propionic acid methyl ester Methyl 2-(8-amino-5-quinolyl)-3,3,3-trifluoro-2-hydroxy-propanoate Methyl 2-(8-aminoquinolin-5-yl)-3,3,3-trifluoro-2-hydroxypropanoate Methyl 2-(8-azanylquinolin-5-yl)-3,3,3-tris(fluoranyl)-2-oxidanyl-propanoate Propionic acid, 2-(8-aminoquinolin-5-yl)-3,3,3-trifluoro-2-hydroxy-, methyl ester
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Formula C13H11F3N2O3
InChI InChI=1S/C13H11F3N2O3/c1-21-11(19)12(20,13(14,15)16)8-4-5-9(17)10-7(8)3-2-6-18-10/h2-6,20H,17H2,1H3
InChIKey KJWQDDIXCXBRAH-UHFFFAOYSA-N
Molecular Weight 300.237 g/mol
SMILES Nc1c2c(c(C(C(F)(F)F)(C(=O)OC)O)cc1)cccn2
SPLASH splash10-006x-4931000000-c9f1091d9ca518795942
Source of Spectrum AD-0-2532-0
Wiley ID 1436128