| SpectraBase Compound ID | Hk8AzpZ0uiw |
|---|---|
| InChI | InChI=1S/C17H14Cl2O4/c1-2-22-16(20)13-5-3-4-6-14(13)17(21)23-10-11-7-8-12(18)9-15(11)19/h3-9H,2,10H2,1H3 |
| InChIKey | MWSRTAPGXCAQAB-UHFFFAOYSA-N |
| Mol Weight | 353.2 g/mol |
| Molecular Formula | C17H14Cl2O4 |
| Exact Mass | 352.026914 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | K2Mxu71hMSf |
|---|---|
| Name | Phthalic acid, 2,4-dichlorobenzyl ethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 352.026914327 u |
| Formula | C17H14Cl2O4 |
| InChI | InChI=1S/C17H14Cl2O4/c1-2-22-16(20)13-5-3-4-6-14(13)17(21)23-10-11-7-8-12(18)9-15(11)19/h3-9H,2,10H2,1H3 |
| InChIKey | MWSRTAPGXCAQAB-UHFFFAOYSA-N |
| Molecular Weight | 353.201 g/mol |
| SMILES | C1=CC(=C(C=C1)C(=O)OCC1=C(C=C(C=C1)Cl)Cl)C(=O)OCC |