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2,6-Pyridinedicarboxylic acid, butyl 5-methoxy-3-methylpent-2-yl ester

View entire compound with spectra: 1 NMR

2,6-Pyridinedicarboxylic acid, butyl 5-methoxy-3-methylpent-2-yl ester
SpectraBase Compound ID 2gxBMopvwcv
InChI InChI=1S/C18H27NO5/c1-5-6-11-23-17(20)15-8-7-9-16(19-15)18(21)24-14(3)13(2)10-12-22-4/h7-9,13-14H,5-6,10-12H2,1-4H3
InChIKey QKQGRIPBYLYVBB-UHFFFAOYSA-N
Mol Weight 337.42 g/mol
Molecular Formula C18H27NO5
Exact Mass 337.188923 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID H977Y3QQV8F
Name 2,6-Pyridinedicarboxylic acid, butyl 5-methoxy-3-methylpent-2-yl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 337.188922968 u
Formula C18H27NO5
InChI InChI=1S/C18H27NO5/c1-5-6-11-23-17(20)15-8-7-9-16(19-15)18(21)24-14(3)13(2)10-12-22-4/h7-9,13-14H,5-6,10-12H2,1-4H3
InChIKey QKQGRIPBYLYVBB-UHFFFAOYSA-N
Molecular Weight 337.416 g/mol
SMILES CC(OC(C1=NC(=CC=C1)C(OCCCC)=O)=O)C(CCOC)C