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8-Bromo-4-keto-7-methoxy-1H-quinoline-3-carboxylic acid ethyl ester
SpectraBase Compound ID 8cJJZDR0FWW
InChI InChI=1S/C13H12BrNO4/c1-3-19-13(17)8-6-15-11-7(12(8)16)4-5-9(18-2)10(11)14/h4-6H,3H2,1-2H3,(H,15,16)
InChIKey XCSFWCFFXJGACS-UHFFFAOYSA-N
Mol Weight 326.15 g/mol
Molecular Formula C13H12BrNO4
Exact Mass 324.994971 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2v2EndZBCq
Name 8-Bromo-4-keto-7-methoxy-1H-quinoline-3-carboxylic acid ethyl ester
Alternate Name(s) 8-Bromo-7-methoxy-4-oxo-1H-quinoline-3-carboxylic acid ethyl ester Ethyl 8-bromanyl-7-methoxy-4-oxidanylidene-1H-quinoline-3-carboxylate Ethyl 8-bromo-7-methoxy-4-oxo-1H-quinoline-3-carboxylate
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Formula C13H12BrNO4
InChI InChI=1S/C13H12BrNO4/c1-3-19-13(17)8-6-15-11-7(12(8)16)4-5-9(18-2)10(11)14/h4-6H,3H2,1-2H3,(H,15,16)
InChIKey XCSFWCFFXJGACS-UHFFFAOYSA-N
Molecular Weight 326.146 g/mol
SMILES N1c2c(c(ccc2C(C(=C1)C(=O)OCC)=O)OC)Br
SPLASH splash10-0059-1094000000-7c6bd561ac8a2ffcca49
Source of Spectrum Y-31-1295-4
Wiley ID 761624