| SpectraBase Compound ID | Dq0TzHgZlve |
|---|---|
| InChI | InChI=1S/C21H14ClN/c22-17-12-10-16(11-13-17)21-19-9-5-4-8-18(19)20(14-23-21)15-6-2-1-3-7-15/h1-14H |
| InChIKey | WYNBIGFXHASOGO-UHFFFAOYSA-N |
| Mol Weight | 315.8 g/mol |
| Molecular Formula | C21H14ClN |
| Exact Mass | 315.081477 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BAOVxt7t61A |
|---|---|
| Name | 1-(4-Chlorophenyl)-4-phenylisoquinoline |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 315.081477155 u |
| Formula | C21H14ClN |
| InChI | InChI=1S/C21H14ClN/c22-17-12-10-16(11-13-17)21-19-9-5-4-8-18(19)20(14-23-21)15-6-2-1-3-7-15/h1-14H |
| InChIKey | WYNBIGFXHASOGO-UHFFFAOYSA-N |
| Molecular Weight | 315.803 g/mol |
| SMILES | C1(=NC=C(C=2C=CC=CC12)C=1C=CC=CC1)C=1C=CC(=CC1)Cl |