| SpectraBase Compound ID | 1WeOkTE73CZ |
|---|---|
| InChI | InChI=1S/C9H11ClO/c10-6-7-11-8-9-4-2-1-3-5-9/h1-5H,6-8H2 |
| InChIKey | UPIMXDQREQJWMR-UHFFFAOYSA-N |
| Mol Weight | 170.64 g/mol |
| Molecular Formula | C9H11ClO |
| Exact Mass | 170.049843 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | HQpzffgNRA9 |
|---|---|
| Name | Benzyl 2-chloroethyl ether |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 170.049842673 u |
| Formula | C9H11ClO |
| InChI | InChI=1S/C9H11ClO/c10-6-7-11-8-9-4-2-1-3-5-9/h1-5H,6-8H2 |
| InChIKey | UPIMXDQREQJWMR-UHFFFAOYSA-N |
| Molecular Weight | 170.639 g/mol |
| SMILES | C=1C=CC=C(C1)COCCCl |
| Spectrum/Structure Validation Score (Raman) | 0.990227 |