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6-(7-amino-5,8-diketo-2-quinolyl)picolinic acid methyl ester
SpectraBase Compound ID AgWfW02VBd8
InChI InChI=1S/C16H11N3O4/c1-23-16(22)12-4-2-3-10(18-12)11-6-5-8-13(20)7-9(17)15(21)14(8)19-11/h2-7H,17H2,1H3
InChIKey MTOOBTZRKRGALM-UHFFFAOYSA-N
Mol Weight 309.28 g/mol
Molecular Formula C16H11N3O4
Exact Mass 309.074956 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EOy8L0qOSTM
Name 6-(7-amino-5,8-diketo-2-quinolyl)picolinic acid methyl ester
Alternate Name(s) 6-(7-amino-5,8-dioxo-2-quinolinyl)-2-pyridinecarboxylic acid methyl ester methyl 6-(7-amino-5,8-dioxo-2-quinolyl)pyridine-2-carboxylate methyl 6-(7-amino-5,8-dioxoquinolin-2-yl)pyridine-2-carboxylate methyl 6-[7-azanyl-5,8-bis(oxidanylidene)quinolin-2-yl]pyridine-2-carboxylate
CAS Registry Number 110144-33-7
Comments Less than 3 mono-isotopic peaks
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Formula C16H11N3O4
InChI InChI=1S/C16H11N3O4/c1-23-16(22)12-4-2-3-10(18-12)11-6-5-8-13(20)7-9(17)15(21)14(8)19-11/h2-7H,17H2,1H3
InChIKey MTOOBTZRKRGALM-UHFFFAOYSA-N
Molecular Weight 309.281 g/mol
SMILES NC=1C(c2nc(-c3nc(C(=O)OC)ccc3)ccc2C(C1)=O)=O
SPLASH splash10-0udi-0090000000-09111675a059e5ad534e
Source of Spectrum Y-24-1258-15
Wiley ID 1310582