| SpectraBase Compound ID | YQfCJae6Vh |
|---|---|
| InChI | InChI=1S/C22H26O4/c23-21(25-17-15-19-9-3-1-4-10-19)13-7-8-14-22(24)26-18-16-20-11-5-2-6-12-20/h1-6,9-12H,7-8,13-18H2 |
| InChIKey | SQRPIABVZLDTIX-UHFFFAOYSA-N |
| Mol Weight | 354.45 g/mol |
| Molecular Formula | C22H26O4 |
| Exact Mass | 354.183109 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GaHywHUePaD |
|---|---|
| Name | Adipic acid, di(2-phenylethyl) ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 354.183109313 u |
| Formula | C22H26O4 |
| InChI | InChI=1S/C22H26O4/c23-21(25-17-15-19-9-3-1-4-10-19)13-7-8-14-22(24)26-18-16-20-11-5-2-6-12-20/h1-6,9-12H,7-8,13-18H2 |
| InChIKey | SQRPIABVZLDTIX-UHFFFAOYSA-N |
| Molecular Weight | 354.446 g/mol |
| SMILES | C(=O)(CCCCC(OCCC1=CC=CC=C1)=O)OCCC1=CC=CC=C1 |