| SpectraBase Compound ID | 2Pw82locjRW |
|---|---|
| InChI | InChI=1S/C8H9ClO2/c1-10-6-3-4-7(9)8(5-6)11-2/h3-5H,1-2H3 |
| InChIKey | OACCRGFGCIQFNR-UHFFFAOYSA-N |
| Mol Weight | 172.61 g/mol |
| Molecular Formula | C8H9ClO2 |
| Exact Mass | 172.029107 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 7fO8mUna024 |
|---|---|
| Name | 1-Chloro-2,4-dimethoxybenzene |
| 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/c1-10-6-3-4-7(9)8(5-6)11-2/h3-5H,1-2H3 |
| InChIKey | OACCRGFGCIQFNR-UHFFFAOYSA-N |
| Molecular Weight | 172.611 g/mol |
| SMILES | C1(=C(C=CC(=C1)OC)Cl)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.943748 |