| SpectraBase Compound ID | 9B3onXfbKSB |
|---|---|
| InChI | InChI=1S/C25H37NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-20-28-25(27)23-17-18-24-22(21-23)16-15-19-26-24/h15-19,21H,2-14,20H2,1H3 |
| InChIKey | QHEFIFPFWPVHGB-UHFFFAOYSA-N |
| Mol Weight | 383.6 g/mol |
| Molecular Formula | C25H37NO2 |
| Exact Mass | 383.282429 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | J2cV4La8LI6 |
|---|---|
| Name | Quinoline-6-carboxylic acid, pentadecyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 383.282429433 u |
| Formula | C25H37NO2 |
| InChI | InChI=1S/C25H37NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-20-28-25(27)23-17-18-24-22(21-23)16-15-19-26-24/h15-19,21H,2-14,20H2,1H3 |
| InChIKey | QHEFIFPFWPVHGB-UHFFFAOYSA-N |
| Molecular Weight | 383.576 g/mol |
| SMILES | C12=CC=C(C=C2C=CC=N1)C(OCCCCCCCCCCCCCCC)=O |