| SpectraBase Compound ID | 6VZJqs41WFC |
|---|---|
| InChI | InChI=1S/C8H8Cl2O2/c1-4(11)6-2-5(9)3-7(10)8(6)12/h2-4,11-12H,1H3 |
| InChIKey | ZMRDTAGYUSUYPY-UHFFFAOYSA-N |
| Mol Weight | 207.06 g/mol |
| Molecular Formula | C8H8Cl2O2 |
| Exact Mass | 205.990135 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 56gilTK9ZW9 |
|---|---|
| Name | Benzenemethanol, 3,5-dichloro-2-hydroxy-alpha-methyl- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 205.990134896 u |
| Formula | C8H8Cl2O2 |
| InChI | InChI=1S/C8H8Cl2O2/c1-4(11)6-2-5(9)3-7(10)8(6)12/h2-4,11-12H,1H3 |
| InChIKey | ZMRDTAGYUSUYPY-UHFFFAOYSA-N |
| Molecular Weight | 207.056 g/mol |
| SMILES | OC(C1=CC(=CC(=C1O)Cl)Cl)C |
| Spectrum/Structure Validation Score (Raman) | 0.767105 |