| SpectraBase Compound ID | BBoO8nrKOQh |
|---|---|
| InChI | InChI=1S/2C5H8Cl2O2/c2*1-3(6)4(7)5(8)9-2/h2*3-4H,1-2H3/t2*3-,4-/m10/s1 |
| InChIKey | ZMNIDHXTVUKISV-CKQOXSRLSA-N |
| Mol Weight | 342.05 g/mol |
| Molecular Formula | C10H16Cl4O4 |
| Exact Mass | 339.98027 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EnBmrVoyElb |
|---|---|
| Name | Erythro-2,3-dichlorobutyric acid, methyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 339.980269791 u |
| Formula | C10H16Cl4O4 |
| InChI | InChI=1S/2C5H8Cl2O2/c2*1-3(6)4(7)5(8)9-2/h2*3-4H,1-2H3/t2*3-,4-/m10/s1 |
| InChIKey | ZMNIDHXTVUKISV-CKQOXSRLSA-N |
| Molecular Weight | 342.046 g/mol |
| Nominal Mass | 340 u |
| SMILES | [C@](Cl)(C)([C@](C(=O)OC)(Cl)[H])[H].[C@@](Cl)(C)([C@@](C(=O)OC)(Cl)[H])[H] |