| SpectraBase Compound ID | K5Sb1bW60sk |
|---|---|
| InChI | InChI=1S/C15H20O4/c1-3-4-5-6-11-19-15(17)13-9-7-12(8-10-13)14(16)18-2/h7-10H,3-6,11H2,1-2H3 |
| InChIKey | VQIJGRLSXRMYNR-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 | DKfY9KDRQB9 |
|---|---|
| Name | Terephthalic acid, hexyl methyl 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/c1-3-4-5-6-11-19-15(17)13-9-7-12(8-10-13)14(16)18-2/h7-10H,3-6,11H2,1-2H3 |
| InChIKey | VQIJGRLSXRMYNR-UHFFFAOYSA-N |
| Molecular Weight | 264.321 g/mol |
| SMILES | C1=CC(=CC=C1C(OC)=O)C(OCCCCCC)=O |