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2,6-Pyridinedicarboxylic acid, di(2-(2-methoxyethyl)hexyl) ester

View entire compound with spectra: 1 NMR

2,6-Pyridinedicarboxylic acid, di(2-(2-methoxyethyl)hexyl) ester
SpectraBase Compound ID Jl9ljp0B6Us
InChI InChI=1S/C25H41NO6/c1-5-7-10-20(14-16-29-3)18-31-24(27)22-12-9-13-23(26-22)25(28)32-19-21(11-8-6-2)15-17-30-4/h9,12-13,20-21H,5-8,10-11,14-19H2,1-4H3
InChIKey VACAECYFDALQKC-UHFFFAOYSA-N
Mol Weight 451.6 g/mol
Molecular Formula C25H41NO6
Exact Mass 451.293388 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID A0lcYAC7DO0
Name 2,6-Pyridinedicarboxylic acid, di(2-(2-methoxyethyl)hexyl) ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 451.293388038 u
Formula C25H41NO6
InChI InChI=1S/C25H41NO6/c1-5-7-10-20(14-16-29-3)18-31-24(27)22-12-9-13-23(26-22)25(28)32-19-21(11-8-6-2)15-17-30-4/h9,12-13,20-21H,5-8,10-11,14-19H2,1-4H3
InChIKey VACAECYFDALQKC-UHFFFAOYSA-N
Molecular Weight 451.604 g/mol
SMILES COCCC(COC(C=1N=C(C(OCC(CCCC)CCOC)=O)C=CC1)=O)CCCC