| SpectraBase Compound ID | Ik6iPzNKewz |
|---|---|
| InChI | InChI=1S/C9H7Cl3O2/c1-5-4-6(2-3-7(5)10)14-9(13)8(11)12/h2-4,8H,1H3 |
| InChIKey | UQBBZCIABMQCNL-UHFFFAOYSA-N |
| Mol Weight | 253.51 g/mol |
| Molecular Formula | C9H7Cl3O2 |
| Exact Mass | 251.951163 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | EB8aDTZugtz |
|---|---|
| Name | 2,2-Dichloroacetic acid, 3-methyl-4-chlorophenyl ester |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H7Cl3O2 |
| InChI | InChI=1S/C9H7Cl3O2/c1-5-4-6(2-3-7(5)10)14-9(13)8(11)12/h2-4,8H,1H3 |
| InChIKey | UQBBZCIABMQCNL-UHFFFAOYSA-N |
| Molecular Weight | 253.512 g/mol |
| SMILES | C(C(=O)Oc1cc(c(cc1)Cl)C)(Cl)Cl |
| SPLASH | splash10-0006-4900000000-254a003c0f65cc60e432 |
| Source of Spectrum | TIPS-2023-58-0 |
| Wiley ID | 1884766 |