| SpectraBase Compound ID | CJYXOo7SXNX |
|---|---|
| InChI | InChI=1S/C20H20O4/c21-19(23-15-9-3-1-4-10-15)17-13-7-8-14-18(17)20(22)24-16-11-5-2-6-12-16/h1,3-4,7-10,13-14,16H,2,5-6,11-12H2 |
| InChIKey | ORDLFWFBIHLAOM-UHFFFAOYSA-N |
| Mol Weight | 324.38 g/mol |
| Molecular Formula | C20H20O4 |
| Exact Mass | 324.136159 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KuKvvpB68l0 |
|---|---|
| Name | Phthalic acid, cyclohexyl phenyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 324.136159120 u |
| Formula | C20H20O4 |
| InChI | InChI=1S/C20H20O4/c21-19(23-15-9-3-1-4-10-15)17-13-7-8-14-18(17)20(22)24-16-11-5-2-6-12-16/h1,3-4,7-10,13-14,16H,2,5-6,11-12H2 |
| InChIKey | ORDLFWFBIHLAOM-UHFFFAOYSA-N |
| Molecular Weight | 324.376 g/mol |
| SMILES | C1(=C(C=CC=C1)C(OC1CCCCC1)=O)C(OC1=CC=CC=C1)=O |