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4-(1,3-benzodioxol-5-yl)-1-(2,5-dimethylphenyl)-4H-pyridine-3,5-dicarboxylic acid diethyl ester
SpectraBase Compound ID 1T8n9b0pV69
InChI InChI=1S/C26H27NO6/c1-5-30-25(28)19-13-27(21-11-16(3)7-8-17(21)4)14-20(26(29)31-6-2)24(19)18-9-10-22-23(12-18)33-15-32-22/h7-14,24H,5-6,15H2,1-4H3
InChIKey QTQXCUKSGDAYPY-UHFFFAOYSA-N
Mol Weight 449.5 g/mol
Molecular Formula C26H27NO6
Exact Mass 449.183838 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Bd8elxnjtl
Name 4-(1,3-benzodioxol-5-yl)-1-(2,5-dimethylphenyl)-4H-pyridine-3,5-dicarboxylic acid diethyl ester
Alternate Name(s) Diethyl 4-(1,3-benzodioxol-5-yl)-1-(2,5-dimethylphenyl)-1,4-dihydro-3,5-pyridinedicarboxylate Diethyl 4-(1,3-benzodioxol-5-yl)-1-(2,5-dimethylphenyl)-4H-pyridine-3,5-dicarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H27NO6
InChI InChI=1S/C26H27NO6/c1-5-30-25(28)19-13-27(21-11-16(3)7-8-17(21)4)14-20(26(29)31-6-2)24(19)18-9-10-22-23(12-18)33-15-32-22/h7-14,24H,5-6,15H2,1-4H3
InChIKey QTQXCUKSGDAYPY-UHFFFAOYSA-N
Molecular Weight 449.503 g/mol
SMILES C=1(C(C(C(=O)OCC)=CN(C1)c1c(ccc(c1)C)C)c1cc2OCOc2cc1)C(=O)OCC
SPLASH splash10-004i-6639100000-09f2cdfdfba950aa0976
Wiley ID 1461698