| SpectraBase Compound ID | 3hmrYGRqHVt |
|---|---|
| InChI | InChI=1S/C8H9ClO2/c9-7-2-1-3-8(6-7)11-5-4-10/h1-3,6,10H,4-5H2 |
| InChIKey | GARMQVNIPCKVOJ-UHFFFAOYSA-N |
| Mol Weight | 172.61 g/mol |
| Molecular Formula | C8H9ClO2 |
| Exact Mass | 172.029107 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 5LIiBZtSVdJ |
|---|---|
| Name | Ethanol, 2-(3-chlorophenoxy)- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 172.029107228 u |
| Formula | C8H9ClO2 |
| InChI | InChI=1S/C8H9ClO2/c9-7-2-1-3-8(6-7)11-5-4-10/h1-3,6,10H,4-5H2 |
| InChIKey | GARMQVNIPCKVOJ-UHFFFAOYSA-N |
| SMILES | OCCOC1=CC=CC(=C1)Cl |
| Spectrum/Structure Validation Score (Raman) | 0.971804 |