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4-(1,3-benzodioxol-5-yl)-1-(4-fluorophenyl)-4H-pyridine-3,5-dicarboxylic acid diethyl ester
SpectraBase Compound ID BNWyusaUrft
InChI InChI=1S/C24H22FNO6/c1-3-29-23(27)18-12-26(17-8-6-16(25)7-9-17)13-19(24(28)30-4-2)22(18)15-5-10-20-21(11-15)32-14-31-20/h5-13,22H,3-4,14H2,1-2H3
InChIKey FIAAVKULSCVDKH-UHFFFAOYSA-N
Mol Weight 439.44 g/mol
Molecular Formula C24H22FNO6
Exact Mass 439.143116 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IG4P9Uh8BxG
Name 4-(1,3-benzodioxol-5-yl)-1-(4-fluorophenyl)-4H-pyridine-3,5-dicarboxylic acid diethyl ester
Alternate Name(s) Diethyl 4-(1,3-benzodioxol-5-yl)-1-(4-fluorophenyl)-4H-pyridine-3,5-dicarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H22FNO6
InChI InChI=1S/C24H22FNO6/c1-3-29-23(27)18-12-26(17-8-6-16(25)7-9-17)13-19(24(28)30-4-2)22(18)15-5-10-20-21(11-15)32-14-31-20/h5-13,22H,3-4,14H2,1-2H3
InChIKey FIAAVKULSCVDKH-UHFFFAOYSA-N
Molecular Weight 439.439 g/mol
SMILES C=1(C(C(C(=O)OCC)=CN(C1)c1ccc(cc1)F)c1cc2OCOc2cc1)C(=O)OCC
SPLASH splash10-014i-2349100000-26f42898bf28725bb84b
Wiley ID 1462211