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2-(4-Isobutoxyphenyl)-4-quinolinecarboxylic acid

View entire compound with spectra: 2 NMR

2-(4-Isobutoxyphenyl)-4-quinolinecarboxylic acid
SpectraBase Compound ID 9yEuPtyEOD5
InChI InChI=1S/C20H19NO3/c1-13(2)12-24-15-9-7-14(8-10-15)19-11-17(20(22)23)16-5-3-4-6-18(16)21-19/h3-11,13H,12H2,1-2H3,(H,22,23)
InChIKey HIOOLUKXWVAGRU-UHFFFAOYSA-N
Mol Weight 321.38 g/mol
Molecular Formula C20H19NO3
Exact Mass 321.136493 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6ogj2LBZ4Q4
Name 2-(4-Isobutoxyphenyl)-4-quinolinecarboxylic acid
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 321.136493473 u
Formula C20H19NO3
InChI InChI=1S/C20H19NO3/c1-13(2)12-24-15-9-7-14(8-10-15)19-11-17(20(22)23)16-5-3-4-6-18(16)21-19/h3-11,13H,12H2,1-2H3,(H,22,23)
InChIKey HIOOLUKXWVAGRU-UHFFFAOYSA-N
Molecular Weight 321.376 g/mol
SMILES OC(C1=CC(C2=CC=C(OCC(C)C)C=C2)=NC2=C1C=CC=C2)=O