| SpectraBase Compound ID | lo53UsFRhF |
|---|---|
| InChI | InChI=1S/C19H20O4/c20-18(22-13-11-16-7-3-1-4-8-16)15-19(21)23-14-12-17-9-5-2-6-10-17/h1-10H,11-15H2 |
| InChIKey | MEYCZPKWKIUMEK-UHFFFAOYSA-N |
| Mol Weight | 312.37 g/mol |
| Molecular Formula | C19H20O4 |
| Exact Mass | 312.136159 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KolDE4tzQ4B |
|---|---|
| Name | Malonic acid di-2-phenylethylester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 312.136159120 u |
| Formula | C19H20O4 |
| InChI | InChI=1S/C19H20O4/c20-18(22-13-11-16-7-3-1-4-8-16)15-19(21)23-14-12-17-9-5-2-6-10-17/h1-10H,11-15H2 |
| InChIKey | MEYCZPKWKIUMEK-UHFFFAOYSA-N |
| Molecular Weight | 312.365 g/mol |
| SMILES | C=1C=C(CCOC(CC(OCCC2=CC=CC=C2)=O)=O)C=CC1 |