| SpectraBase Compound ID | CuXS8OwoDHD |
|---|---|
| InChI | InChI=1S/C7H6Cl2O/c1-4-2-5(8)3-6(9)7(4)10/h2-3,10H,1H3 |
| InChIKey | WJQZZLQMLJPKQH-UHFFFAOYSA-N |
| Mol Weight | 177.03 g/mol |
| Molecular Formula | C7H6Cl2O |
| Exact Mass | 175.97957 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 1RosgWU5JBm |
|---|---|
| Name | 4,6-Dichloro-o-cresol |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 175.979570212 u |
| Formula | C7H6Cl2O |
| InChI | InChI=1S/C7H6Cl2O/c1-4-2-5(8)3-6(9)7(4)10/h2-3,10H,1H3 |
| InChIKey | WJQZZLQMLJPKQH-UHFFFAOYSA-N |
| Molecular Weight | 177.030 g/mol |
| SMILES | OC1=C(C=C(C=C1C)Cl)Cl |
| Spectrum/Structure Validation Score (Raman) | 0.787683 |