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4-(4-Chloro-3-fluoro-phenyl)-1-(2-thenyl)-4H-pyridine-3,5-dicarboxylic acid dimethyl ester
SpectraBase Compound ID EeUKrhG7Ifo
InChI InChI=1S/C20H17ClFNO4S/c1-26-19(24)14-10-23(9-13-4-3-7-28-13)11-15(20(25)27-2)18(14)12-5-6-16(21)17(22)8-12/h3-8,10-11,18H,9H2,1-2H3
InChIKey AAMMACMGYNCIHF-UHFFFAOYSA-N
Mol Weight 421.87 g/mol
Molecular Formula C20H17ClFNO4S
Exact Mass 421.055085 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BgkPRA8ZxL5
Name 4-(4-Chloro-3-fluoro-phenyl)-1-(2-thenyl)-4H-pyridine-3,5-dicarboxylic acid dimethyl ester
Alternate Name(s) 4-(4-Chloro-3-fluorophenyl)-1-(thiophen-2-ylmethyl)-4H-pyridine-3,5-dicarboxylic acid dimethyl ester Dimethyl 4-(4-chloranyl-3-fluoranyl-phenyl)-1-(thiophen-2-ylmethyl)-4H-pyridine-3,5-dicarboxylate Dimethyl 4-(4-chloro-3-fluoro-phenyl)-1-(2-thienylmethyl)-4H-pyridine-3,5-dicarboxylate Dimethyl 4-(4-chloro-3-fluorophenyl)-1-(thiophen-2-ylmethyl)-4H-pyridine-3,5-dicarboxylate
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Formula C20H17ClFNO4S
InChI InChI=1S/C20H17ClFNO4S/c1-26-19(24)14-10-23(9-13-4-3-7-28-13)11-15(20(25)27-2)18(14)12-5-6-16(21)17(22)8-12/h3-8,10-11,18H,9H2,1-2H3
InChIKey AAMMACMGYNCIHF-UHFFFAOYSA-N
Molecular Weight 421.870 g/mol
SMILES C=1(C(C(C(=O)OC)=CN(C1)Cc1sccc1)c1cc(F)c(cc1)Cl)C(=O)OC
SPLASH splash10-0002-9110000000-d6ed178ef2f5838b1633
Wiley ID 1458980