| SpectraBase Compound ID | 4XGmNrTNbEm |
|---|---|
| InChI | InChI=1S/C18H14ClN/c19-17-9-7-16(8-10-17)18-11-6-15(13-20-18)12-14-4-2-1-3-5-14/h1-11,13H,12H2 |
| InChIKey | VXDAZENWJBBLDO-UHFFFAOYSA-N |
| Mol Weight | 279.77 g/mol |
| Molecular Formula | C18H14ClN |
| Exact Mass | 279.081477 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GPWXQdC4Pg5 |
|---|---|
| Name | 5-Benzyl-2-(4-chlorophenyl)pyridine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 279.081477155 u |
| Formula | C18H14ClN |
| InChI | InChI=1S/C18H14ClN/c19-17-9-7-16(8-10-17)18-11-6-15(13-20-18)12-14-4-2-1-3-5-14/h1-11,13H,12H2 |
| InChIKey | VXDAZENWJBBLDO-UHFFFAOYSA-N |
| SMILES | C=1C=C(CC=2C=CC(=NC2)C2=CC=C(C=C2)Cl)C=CC1 |