| SpectraBase Compound ID | 30ZjTjVui5o |
|---|---|
| InChI | InChI=1S/C19H17NO2/c1-2-5-13-8-10-14(11-9-13)18-12-16(19(21)22)15-6-3-4-7-17(15)20-18/h3-4,6-12H,2,5H2,1H3,(H,21,22) |
| InChIKey | CMIVTPBNVBBQEH-UHFFFAOYSA-N |
| Mol Weight | 291.35 g/mol |
| Molecular Formula | C19H17NO2 |
| Exact Mass | 291.125929 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4ctQw4WDaKo |
|---|---|
| Name | 2-(4-Propylphenyl)-4-quinolinecarboxylic acid |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 291.125928789 u |
| Formula | C19H17NO2 |
| InChI | InChI=1S/C19H17NO2/c1-2-5-13-8-10-14(11-9-13)18-12-16(19(21)22)15-6-3-4-7-17(15)20-18/h3-4,6-12H,2,5H2,1H3,(H,21,22) |
| InChIKey | CMIVTPBNVBBQEH-UHFFFAOYSA-N |
| Molecular Weight | 291.350 g/mol |
| SMILES | OC(C1=CC(C2=CC=C(C=C2)CCC)=NC2=C1C=CC=C2)=O |