| SpectraBase Compound ID | GuKFbeNsjI6 |
|---|---|
| InChI | InChI=1S/C23H36O4/c1-4-6-7-8-9-10-11-12-18-26-22(24)20-14-16-21(17-15-20)23(25)27-19(3)13-5-2/h14-17,19H,4-13,18H2,1-3H3 |
| InChIKey | YBCLEGMVMAJLIT-UHFFFAOYSA-N |
| Mol Weight | 376.5 g/mol |
| Molecular Formula | C23H36O4 |
| Exact Mass | 376.26136 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 | BcRKXWsCVi4 |
|---|---|
| Name | Terephthalic acid, decyl 2-pentyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 376.261359635 u |
| Formula | C23H36O4 |
| InChI | InChI=1S/C23H36O4/c1-4-6-7-8-9-10-11-12-18-26-22(24)20-14-16-21(17-15-20)23(25)27-19(3)13-5-2/h14-17,19H,4-13,18H2,1-3H3 |
| InChIKey | YBCLEGMVMAJLIT-UHFFFAOYSA-N |
| Molecular Weight | 376.537 g/mol |
| SMILES | CCCCCCCCCCOC(C1=CC=C(C=C1)C(OC(CCC)C)=O)=O |