| SpectraBase Compound ID | 48DkGzSv12r |
|---|---|
| InChI | InChI=1S/C7H5Cl3O2/c1-12-4-2-3(8)5(9)6(10)7(4)11/h2,11H,1H3 |
| InChIKey | NIAJPNQTKGWEOI-UHFFFAOYSA-N |
| Mol Weight | 227.47 g/mol |
| Molecular Formula | C7H5Cl3O2 |
| Exact Mass | 225.935512 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 14wZPGbRKlz |
|---|---|
| Name | Phenol, 2,3,4-trichloro-6-methoxy- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 225.935512499 u |
| Formula | C7H5Cl3O2 |
| InChI | InChI=1S/C7H5Cl3O2/c1-12-4-2-3(8)5(9)6(10)7(4)11/h2,11H,1H3 |
| InChIKey | NIAJPNQTKGWEOI-UHFFFAOYSA-N |
| Molecular Weight | 227.474 g/mol |
| SMILES | C=1(C(=C(Cl)C=C(C1O)OC)Cl)Cl |