| SpectraBase Compound ID | 8racT7CllKK |
|---|---|
| InChI | InChI=1S/C20H28O5/c1-4-6-7-16(5-2)14-24-19(22)12-13-20(23)25-18-10-8-17(9-11-18)15(3)21/h8-11,16H,4-7,12-14H2,1-3H3 |
| InChIKey | HVGDOPFJKOQUNL-UHFFFAOYSA-N |
| Mol Weight | 348.44 g/mol |
| Molecular Formula | C20H28O5 |
| Exact Mass | 348.193674 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JURlb0bd4Fb |
|---|---|
| Name | Succinic acid, 2-ethylhexyl 4-acetylphenyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 348.193673997 u |
| Formula | C20H28O5 |
| InChI | InChI=1S/C20H28O5/c1-4-6-7-16(5-2)14-24-19(22)12-13-20(23)25-18-10-8-17(9-11-18)15(3)21/h8-11,16H,4-7,12-14H2,1-3H3 |
| InChIKey | HVGDOPFJKOQUNL-UHFFFAOYSA-N |
| Molecular Weight | 348.439 g/mol |
| SMILES | C(CC(OCC(CC)CCCC)=O)C(OC1=CC=C(C(C)=O)C=C1)=O |