| SpectraBase Compound ID | G2aonNzH2zd |
|---|---|
| InChI | InChI=1S/C7H6ClF/c8-5-6-3-1-2-4-7(6)9/h1-4H,5H2 |
| InChIKey | MOBRMRJUKNQBMY-UHFFFAOYSA-N |
| Mol Weight | 144.58 g/mol |
| Molecular Formula | C7H6ClF |
| Exact Mass | 144.014206 g/mol |
| SpectraBase Spectrum ID | DrP9iQyF5Lv |
|---|---|
| Name | 2-Fluorobenzylchloride |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 144.014206056 u |
| Formula | C7H6ClF |
| InChI | InChI=1S/C7H6ClF/c8-5-6-3-1-2-4-7(6)9/h1-4H,5H2 |
| InChIKey | MOBRMRJUKNQBMY-UHFFFAOYSA-N |
| Molecular Weight | 144.576 g/mol |
| SMILES | C(Cl)C1=C(F)C=CC=C1 |
| Spectrum/Structure Validation Score (Raman) | 0.962363 |