| SpectraBase Compound ID | GCutgB048q7 |
|---|---|
| InChI | InChI=1S/C20H22O4/c1-13-9-14(2)11-18(10-13)24-20(22)8-7-19(21)23-17-6-5-15(3)16(4)12-17/h5-6,9-12H,7-8H2,1-4H3 |
| InChIKey | JMQFAKAKZBTIGP-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 | G6LJOYhNcCt |
|---|---|
| Name | Succinic acid, 3,5-dimethylphenyl 3,4-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/c1-13-9-14(2)11-18(10-13)24-20(22)8-7-19(21)23-17-6-5-15(3)16(4)12-17/h5-6,9-12H,7-8H2,1-4H3 |
| InChIKey | JMQFAKAKZBTIGP-UHFFFAOYSA-N |
| Molecular Weight | 326.392 g/mol |
| SMILES | CC1=CC(=CC(=C1)OC(CCC(=O)OC=1C=C(C(C)=CC1)C)=O)C |