| SpectraBase Compound ID | C9ycu1xn9w8 |
|---|---|
| InChI | InChI=1S/C13H14Cl2O4/c1-2-18-11(16)7-4-8-12(17)19-13-9(14)5-3-6-10(13)15/h3,5-6H,2,4,7-8H2,1H3 |
| InChIKey | AACBPDFCHOUTLQ-UHFFFAOYSA-N |
| Mol Weight | 305.16 g/mol |
| Molecular Formula | C13H14Cl2O4 |
| Exact Mass | 304.026914 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6hxCj5rq7XV |
|---|---|
| Name | Glutaric acid, 2,6-dichlorophenyl ethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 304.026914327 u |
| Formula | C13H14Cl2O4 |
| InChI | InChI=1S/C13H14Cl2O4/c1-2-18-11(16)7-4-8-12(17)19-13-9(14)5-3-6-10(13)15/h3,5-6H,2,4,7-8H2,1H3 |
| InChIKey | AACBPDFCHOUTLQ-UHFFFAOYSA-N |
| Molecular Weight | 305.157 g/mol |
| SMILES | C1=CC(Cl)=C(OC(=O)CCCC(OCC)=O)C(=C1)Cl |