| SpectraBase Compound ID | 6mRrrRUU2pb |
|---|---|
| InChI | InChI=1S/C17H14Cl2O4/c18-12-4-8-14(9-5-12)22-16(20)2-1-3-17(21)23-15-10-6-13(19)7-11-15/h4-11H,1-3H2 |
| InChIKey | MGNHKEGIYRETLD-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 | EAqfa9eEctQ |
|---|---|
| Name | Glutaric acid, di(4-chlorophenyl) 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/c18-12-4-8-14(9-5-12)22-16(20)2-1-3-17(21)23-15-10-6-13(19)7-11-15/h4-11H,1-3H2 |
| InChIKey | MGNHKEGIYRETLD-UHFFFAOYSA-N |
| Molecular Weight | 353.201 g/mol |
| SMILES | C1(=CC=C(C=C1)OC(CCCC(OC1=CC=C(C=C1)Cl)=O)=O)Cl |