| SpectraBase Compound ID | 8pUZK2klmhm |
|---|---|
| InChI | InChI=1S/C20H30O4/c1-4-7-9-17(6-3)15-23-19(21)12-13-20(22)24-18-11-8-10-16(5-2)14-18/h8,10-11,14,17H,4-7,9,12-13,15H2,1-3H3 |
| InChIKey | IPQBIKAIHKPAIH-UHFFFAOYSA-N |
| Mol Weight | 334.46 g/mol |
| Molecular Formula | C20H30O4 |
| Exact Mass | 334.214409 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GznyjTA0dX5 |
|---|---|
| Name | Succinic acid, 2-ethylhexyl 3-ethylphenyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 334.214409442 u |
| Formula | C20H30O4 |
| InChI | InChI=1S/C20H30O4/c1-4-7-9-17(6-3)15-23-19(21)12-13-20(22)24-18-11-8-10-16(5-2)14-18/h8,10-11,14,17H,4-7,9,12-13,15H2,1-3H3 |
| InChIKey | IPQBIKAIHKPAIH-UHFFFAOYSA-N |
| Molecular Weight | 334.456 g/mol |
| SMILES | C(CC(OCC(CC)CCCC)=O)C(OC1=CC(=CC=C1)CC)=O |