| SpectraBase Compound ID | EvOTDyrAhWG |
|---|---|
| InChI | InChI=1S/C15H20O4/c1-4-9-18-14(16)12-5-7-13(8-6-12)15(17)19-10-11(2)3/h5-8,11H,4,9-10H2,1-3H3 |
| InChIKey | XRJVOHJVIRNQSK-UHFFFAOYSA-N |
| Mol Weight | 264.32 g/mol |
| Molecular Formula | C15H20O4 |
| Exact Mass | 264.136159 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | Fy4hxtMpVSi |
|---|---|
| Name | Terephthalic acid, isobutyl propyl 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/c1-4-9-18-14(16)12-5-7-13(8-6-12)15(17)19-10-11(2)3/h5-8,11H,4,9-10H2,1-3H3 |
| InChIKey | XRJVOHJVIRNQSK-UHFFFAOYSA-N |
| Molecular Weight | 264.321 g/mol |
| SMILES | C1(=CC=C(C=C1)C(OCC(C)C)=O)C(OCCC)=O |