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Quinoline-6-carboxylic acid, octadecyl ester

View entire compound with spectra: 1 NMR

Quinoline-6-carboxylic acid, octadecyl ester
SpectraBase Compound ID 72cKtYMR2te
InChI InChI=1S/C28H43NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-23-31-28(30)26-20-21-27-25(24-26)19-18-22-29-27/h18-22,24H,2-17,23H2,1H3
InChIKey OHXYVILJKFSXGP-UHFFFAOYSA-N
Mol Weight 425.7 g/mol
Molecular Formula C28H43NO2
Exact Mass 425.32938 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID sxIW9Oi3ZN
Name Quinoline-6-carboxylic acid, octadecyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 425.329379627 u
Formula C28H43NO2
InChI InChI=1S/C28H43NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-23-31-28(30)26-20-21-27-25(24-26)19-18-22-29-27/h18-22,24H,2-17,23H2,1H3
InChIKey OHXYVILJKFSXGP-UHFFFAOYSA-N
Molecular Weight 425.657 g/mol
SMILES C12=CC=C(C=C2C=CC=N1)C(OCCCCCCCCCCCCCCCCCC)=O