| SpectraBase Compound ID | AenARmdpjyv |
|---|---|
| InChI | InChI=1S/C17H12Cl4O4/c18-10-4-6-14(12(20)8-10)24-16(22)2-1-3-17(23)25-15-7-5-11(19)9-13(15)21/h4-9H,1-3H2 |
| InChIKey | SAYPMZBAWMYDPY-UHFFFAOYSA-N |
| Mol Weight | 422.1 g/mol |
| Molecular Formula | C17H12Cl4O4 |
| Exact Mass | 419.94897 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7fVejaGlex2 |
|---|---|
| Name | Glutaric acid, di(2,4-dichlorophenyl) ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 419.948969662 u |
| Formula | C17H12Cl4O4 |
| InChI | InChI=1S/C17H12Cl4O4/c18-10-4-6-14(12(20)8-10)24-16(22)2-1-3-17(23)25-15-7-5-11(19)9-13(15)21/h4-9H,1-3H2 |
| InChIKey | SAYPMZBAWMYDPY-UHFFFAOYSA-N |
| Molecular Weight | 422.091 g/mol |
| SMILES | C(CCC(OC1=C(C=C(C=C1)Cl)Cl)=O)C(OC=1C(=CC(=CC1)Cl)Cl)=O |