| SpectraBase Compound ID | As5zCJXFtF4 |
|---|---|
| InChI | InChI=1S/C15H20O4/c1-3-5-6-11-19-15(17)13-9-7-12(8-10-13)14(16)18-4-2/h7-10H,3-6,11H2,1-2H3 |
| InChIKey | MGSOBHKSAKMDEL-UHFFFAOYSA-N |
| Mol Weight | 264.32 g/mol |
| Molecular Formula | C15H20O4 |
| Exact Mass | 264.136159 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FXdlvI5vNLI |
|---|---|
| Name | Terephthalic acid, ethyl pentyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 264.136159120 u |
| Formula | C15H20O4 |
| InChI | InChI=1S/C15H20O4/c1-3-5-6-11-19-15(17)13-9-7-12(8-10-13)14(16)18-4-2/h7-10H,3-6,11H2,1-2H3 |
| InChIKey | MGSOBHKSAKMDEL-UHFFFAOYSA-N |
| Molecular Weight | 264.321 g/mol |
| SMILES | CCCCCOC(C1=CC=C(C(OCC)=O)C=C1)=O |