| SpectraBase Compound ID | Bh8pI7oIKk1 |
|---|---|
| InChI | InChI=1S/C23H36O4/c1-3-5-7-8-9-10-11-13-19-27-23(25)21-16-14-20(15-17-21)22(24)26-18-12-6-4-2/h14-17H,3-13,18-19H2,1-2H3 |
| InChIKey | GRWZBYKBMGIWDQ-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 | It25uysG2h8 |
|---|---|
| Name | Terephthalic acid, decyl 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/c1-3-5-7-8-9-10-11-13-19-27-23(25)21-16-14-20(15-17-21)22(24)26-18-12-6-4-2/h14-17H,3-13,18-19H2,1-2H3 |
| InChIKey | GRWZBYKBMGIWDQ-UHFFFAOYSA-N |
| Molecular Weight | 376.537 g/mol |
| SMILES | C(CCCCCOC(=O)C1=CC=C(C=C1)C(=O)OCCCCC)CCCC |