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4-[2-(2,4,6-trimethoxyphenyl)ethynyl]pyridine-2,6-dicarboxylic acid dimethyl ester
SpectraBase Compound ID 71ygeGGzi1i
InChI InChI=1S/C20H19NO7/c1-24-13-10-17(25-2)14(18(11-13)26-3)7-6-12-8-15(19(22)27-4)21-16(9-12)20(23)28-5/h8-11H,1-5H3
InChIKey QFENTTPTBTWCKC-UHFFFAOYSA-N
Mol Weight 385.37 g/mol
Molecular Formula C20H19NO7
Exact Mass 385.116152 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6tB0nRKBqpw
Name 4-[2-(2,4,6-trimethoxyphenyl)ethynyl]pyridine-2,6-dicarboxylic acid dimethyl ester
Alternate Name(s) dimethyl 4-[2-(2,4,6-trimethoxyphenyl)ethynyl]pyridine-2,6-dicarboxylate
Comments Less than 3 mono-isotopic peaks
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Formula C20H19NO7
InChI InChI=1S/C20H19NO7/c1-24-13-10-17(25-2)14(18(11-13)26-3)7-6-12-8-15(19(22)27-4)21-16(9-12)20(23)28-5/h8-11H,1-5H3
InChIKey QFENTTPTBTWCKC-UHFFFAOYSA-N
Molecular Weight 385.372 g/mol
SMILES C(c1c(cc(cc1OC)OC)OC)#Cc1cc(C(=O)OC)nc(c1)C(=O)OC
SPLASH splash10-000i-0009000000-1955374919b67150529f
Source of Spectrum U1-2003-3115-5
Wiley ID 1523808