| SpectraBase Compound ID | H6v6W6u7xho |
|---|---|
| InChI | InChI=1S/C21H24O4/c1-16(2)18-8-10-19(11-9-18)25-21(23)13-12-20(22)24-15-14-17-6-4-3-5-7-17/h3-11,16H,12-15H2,1-2H3 |
| InChIKey | JHFKFNUBAGCTAN-UHFFFAOYSA-N |
| Mol Weight | 340.42 g/mol |
| Molecular Formula | C21H24O4 |
| Exact Mass | 340.167459 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JTmc9IUmPlh |
|---|---|
| Name | Succinic acid, phenethyl 4-isopropylphenyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 340.167459249 u |
| Formula | C21H24O4 |
| InChI | InChI=1S/C21H24O4/c1-16(2)18-8-10-19(11-9-18)25-21(23)13-12-20(22)24-15-14-17-6-4-3-5-7-17/h3-11,16H,12-15H2,1-2H3 |
| InChIKey | JHFKFNUBAGCTAN-UHFFFAOYSA-N |
| Molecular Weight | 340.419 g/mol |
| SMILES | CC(C)C1=CC=C(OC(CCC(OCCC2=CC=CC=C2)=O)=O)C=C1 |