| SpectraBase Compound ID | LRJnePfDpu7 |
|---|---|
| InChI | InChI=1S/C7H7Cl/c8-6-7-4-2-1-3-5-7/h1-5H,6H2 |
| InChIKey | KCXMKQUNVWSEMD-UHFFFAOYSA-N |
| Mol Weight | 126.59 g/mol |
| Molecular Formula | C7H7Cl |
| Exact Mass | 126.023628 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | ADtMySKwDlW |
|---|---|
| Name | Benzyl chloride |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 126.023627925 u |
| Formula | C7H7Cl |
| InChI | InChI=1S/C7H7Cl/c8-6-7-4-2-1-3-5-7/h1-5H,6H2 |
| InChIKey | KCXMKQUNVWSEMD-UHFFFAOYSA-N |
| Molecular Weight | 126.586 g/mol |
| SMILES | C1=CC=CC(=C1)CCl |
| Spectrum/Structure Validation Score (Raman) | 0.992291 |