| SpectraBase Compound ID | RdhoJv4dqj |
|---|---|
| InChI | InChI=1S/C20H12Cl2O4/c21-17-11-10-14(12-18(17)22)26-20(24)16-9-5-4-8-15(16)19(23)25-13-6-2-1-3-7-13/h1-12H |
| InChIKey | RWBYDEJSXZTCND-UHFFFAOYSA-N |
| Mol Weight | 387.22 g/mol |
| Molecular Formula | C20H12Cl2O4 |
| Exact Mass | 386.011264 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LQ1R09wkyXC |
|---|---|
| Name | Phthalic acid, 3,4-dichlorophenyl phenyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 386.011264262 u |
| Formula | C20H12Cl2O4 |
| InChI | InChI=1S/C20H12Cl2O4/c21-17-11-10-14(12-18(17)22)26-20(24)16-9-5-4-8-15(16)19(23)25-13-6-2-1-3-7-13/h1-12H |
| InChIKey | RWBYDEJSXZTCND-UHFFFAOYSA-N |
| Molecular Weight | 387.218 g/mol |
| SMILES | C1(=C(C=CC=C1)C(OC1=CC=CC=C1)=O)C(OC1=CC(=C(C=C1)Cl)Cl)=O |