| SpectraBase Compound ID | 2UeLa4ezNJC |
|---|---|
| InChI | InChI=1S/C10H4Cl6O4/c11-9(12,13)7(17)19-5-2-1-3-6(4-5)20-8(18)10(14,15)16/h1-4H |
| InChIKey | SHTIMQXHYAHSRP-UHFFFAOYSA-N |
| Mol Weight | 400.9 g/mol |
| Molecular Formula | C10H4Cl6O4 |
| Exact Mass | 397.824075 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8T6WVIZIiom |
|---|---|
| Name | 1,3-Benzenediol, o,o'-di(trichloroacetyl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 397.824074805 u |
| Formula | C10H4Cl6O4 |
| InChI | InChI=1S/C10H4Cl6O4/c11-9(12,13)7(17)19-5-2-1-3-6(4-5)20-8(18)10(14,15)16/h1-4H |
| InChIKey | SHTIMQXHYAHSRP-UHFFFAOYSA-N |
| Molecular Weight | 400.856 g/mol |
| SMILES | C1(=CC(=CC=C1)OC(C(Cl)(Cl)Cl)=O)OC(C(Cl)(Cl)Cl)=O |