| SpectraBase Compound ID | Ilz2nJ4CnSG |
|---|---|
| InChI | InChI=1S/C13H14Cl2O5/c1-18-9-3-2-4-10(7-9)20-13(17)6-5-12(16)19-8-11(14)15/h2-4,7,11H,5-6,8H2,1H3 |
| InChIKey | CRGPFGYURXKDME-UHFFFAOYSA-N |
| Mol Weight | 321.16 g/mol |
| Molecular Formula | C13H14Cl2O5 |
| Exact Mass | 320.021829 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7VtjAC8NNkJ |
|---|---|
| Name | Succinic acid, 2,2-dichloroethyl 3-methoxyphenyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 320.021828946 u |
| Formula | C13H14Cl2O5 |
| InChI | InChI=1S/C13H14Cl2O5/c1-18-9-3-2-4-10(7-9)20-13(17)6-5-12(16)19-8-11(14)15/h2-4,7,11H,5-6,8H2,1H3 |
| InChIKey | CRGPFGYURXKDME-UHFFFAOYSA-N |
| Molecular Weight | 321.156 g/mol |
| SMILES | C(CC(OCC(Cl)Cl)=O)C(OC1=CC=CC(=C1)OC)=O |