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2,6-Pyridinedicarboxylic acid, hexyl 1-methoxydec-4-yl ester

View entire compound with spectra: 1 NMR

2,6-Pyridinedicarboxylic acid, hexyl 1-methoxydec-4-yl ester
SpectraBase Compound ID nLuLpY5wWG
InChI InChI=1S/C24H39NO5/c1-4-6-8-10-14-20(15-13-18-28-3)30-24(27)22-17-12-16-21(25-22)23(26)29-19-11-9-7-5-2/h12,16-17,20H,4-11,13-15,18-19H2,1-3H3
InChIKey MXYWWINIQZFMLM-UHFFFAOYSA-N
Mol Weight 421.6 g/mol
Molecular Formula C24H39NO5
Exact Mass 421.282823 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LsppMSBvvlx
Name 2,6-Pyridinedicarboxylic acid, hexyl 1-methoxydec-4-yl ester
Comments Computed using HOSE algorithm
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Exact Mass 421.282823355 u
Formula C24H39NO5
InChI InChI=1S/C24H39NO5/c1-4-6-8-10-14-20(15-13-18-28-3)30-24(27)22-17-12-16-21(25-22)23(26)29-19-11-9-7-5-2/h12,16-17,20H,4-11,13-15,18-19H2,1-3H3
InChIKey MXYWWINIQZFMLM-UHFFFAOYSA-N
Molecular Weight 421.578 g/mol
SMILES CCCCCCC(OC(C1=NC(C(OCCCCCC)=O)=CC=C1)=O)CCCOC