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4-(4-chlorophenyl)pyridine-2,3-dicarboxylic acid diethyl ester
SpectraBase Compound ID 5huqqUWnuEM
InChI InChI=1S/C17H16ClNO4/c1-3-22-16(20)14-13(11-5-7-12(18)8-6-11)9-10-19-15(14)17(21)23-4-2/h5-10H,3-4H2,1-2H3
InChIKey JONJQYLNJDLBHT-UHFFFAOYSA-N
Mol Weight 333.77 g/mol
Molecular Formula C17H16ClNO4
Exact Mass 333.076786 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BJQT2ufGuqO
Name 4-(4-chlorophenyl)pyridine-2,3-dicarboxylic acid diethyl ester
Alternate Name(s) diethyl 4-(4-chlorophenyl)pyridine-2,3-dicarboxylate
Comments Less than 3 mono-isotopic peaks
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Formula C17H16ClNO4
InChI InChI=1S/C17H16ClNO4/c1-3-22-16(20)14-13(11-5-7-12(18)8-6-11)9-10-19-15(14)17(21)23-4-2/h5-10H,3-4H2,1-2H3
InChIKey JONJQYLNJDLBHT-UHFFFAOYSA-N
Molecular Weight 333.771 g/mol
SMILES c1(c(C(=O)OCC)nccc1-c1ccc(cc1)Cl)C(=O)OCC
SPLASH splash10-000i-0901000000-9142c89555f06e617ed3
Source of Spectrum J-61-8098-18
Wiley ID 1330152