| SpectraBase Compound ID | L82eXCsgjb6 |
|---|---|
| InChI | InChI=1S/C15H20O4/c1-3-18-14(16)11-13(15(17)19-4-2)10-12-8-6-5-7-9-12/h5-9,13H,3-4,10-11H2,1-2H3 |
| InChIKey | JZJPBADSXBZWAZ-UHFFFAOYSA-N |
| Mol Weight | 264.32 g/mol |
| Molecular Formula | C15H20O4 |
| Exact Mass | 264.136159 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KxCyOwLTr93 |
|---|---|
| Name | 2-Benzylsuccinic acid, diethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 264.136159120 u |
| Formula | C15H20O4 |
| InChI | InChI=1S/C15H20O4/c1-3-18-14(16)11-13(15(17)19-4-2)10-12-8-6-5-7-9-12/h5-9,13H,3-4,10-11H2,1-2H3 |
| InChIKey | JZJPBADSXBZWAZ-UHFFFAOYSA-N |
| Molecular Weight | 264.321 g/mol |
| SMILES | C(=O)(CC(C(OCC)=O)CC=1C=CC=CC1)OCC |