| SpectraBase Compound ID | 63aVCqipM3K |
|---|---|
| InChI | InChI=1S/C14H16Cl2O4/c1-2-8-19-13(17)4-3-5-14(18)20-12-9-10(15)6-7-11(12)16/h6-7,9H,2-5,8H2,1H3 |
| InChIKey | XMOJJPSPLYDERT-UHFFFAOYSA-N |
| Mol Weight | 319.18 g/mol |
| Molecular Formula | C14H16Cl2O4 |
| Exact Mass | 318.042564 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JqzIyIf7a11 |
|---|---|
| Name | Glutaric acid, 2,5-dichlorophenyl propyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 318.042564391 u |
| Formula | C14H16Cl2O4 |
| InChI | InChI=1S/C14H16Cl2O4/c1-2-8-19-13(17)4-3-5-14(18)20-12-9-10(15)6-7-11(12)16/h6-7,9H,2-5,8H2,1H3 |
| InChIKey | XMOJJPSPLYDERT-UHFFFAOYSA-N |
| Molecular Weight | 319.184 g/mol |
| SMILES | CCCOC(CCCC(OC1=CC(=CC=C1Cl)Cl)=O)=O |