| SpectraBase Compound ID | Bi2JaerVjLr |
|---|---|
| InChI | InChI=1S/C20H13ClO4/c21-17-12-6-7-13-18(17)25-20(23)16-11-5-4-10-15(16)19(22)24-14-8-2-1-3-9-14/h1-13H |
| InChIKey | DFLYDCMNWZITAY-UHFFFAOYSA-N |
| Mol Weight | 352.77 g/mol |
| Molecular Formula | C20H13ClO4 |
| Exact Mass | 352.050237 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 905BltUtEeZ |
|---|---|
| Name | Phthalic acid, 2-chlorophenyl phenyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 352.050236595 u |
| Formula | C20H13ClO4 |
| InChI | InChI=1S/C20H13ClO4/c21-17-12-6-7-13-18(17)25-20(23)16-11-5-4-10-15(16)19(22)24-14-8-2-1-3-9-14/h1-13H |
| InChIKey | DFLYDCMNWZITAY-UHFFFAOYSA-N |
| Molecular Weight | 352.773 g/mol |
| SMILES | C1(=C(C=CC=C1)C(OC1=CC=CC=C1)=O)C(OC1=CC=CC=C1Cl)=O |