| SpectraBase Compound ID | 9OA0XjBL9gF |
|---|---|
| InChI | InChI=1S/C20H22O4/c1-13-7-14(2)10-17(9-13)23-19(21)5-6-20(22)24-18-11-15(3)8-16(4)12-18/h7-12H,5-6H2,1-4H3 |
| InChIKey | PHCRHPMTYVMWKB-UHFFFAOYSA-N |
| Mol Weight | 326.39 g/mol |
| Molecular Formula | C20H22O4 |
| Exact Mass | 326.151809 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3hjYvCzfJGx |
|---|---|
| Name | Succinic acid, di(3,5-dimethylphenyl) ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 326.151809184 u |
| Formula | C20H22O4 |
| InChI | InChI=1S/C20H22O4/c1-13-7-14(2)10-17(9-13)23-19(21)5-6-20(22)24-18-11-15(3)8-16(4)12-18/h7-12H,5-6H2,1-4H3 |
| InChIKey | PHCRHPMTYVMWKB-UHFFFAOYSA-N |
| Molecular Weight | 326.392 g/mol |
| SMILES | CC1=CC(C)=CC(=C1)OC(CCC(OC1=CC(=CC(=C1)C)C)=O)=O |