| SpectraBase Compound ID | LQcjhPdfWU2 |
|---|---|
| InChI | InChI=1S/C24H44O4/c1-3-5-7-9-10-11-12-16-20-28-24(26)22-18-14-13-17-21(22)23(25)27-19-15-8-6-4-2/h21-22H,3-20H2,1-2H3 |
| InChIKey | VXCYTMDMIPWIKM-UHFFFAOYSA-N |
| Mol Weight | 396.6 g/mol |
| Molecular Formula | C24H44O4 |
| Exact Mass | 396.32396 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 | 2emFf5Ipz6s |
|---|---|
| Name | 1,2-Cyclohexanedicarboxylic acid, decyl hexyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 396.323959893 u |
| Formula | C24H44O4 |
| InChI | InChI=1S/C24H44O4/c1-3-5-7-9-10-11-12-16-20-28-24(26)22-18-14-13-17-21(22)23(25)27-19-15-8-6-4-2/h21-22H,3-20H2,1-2H3 |
| InChIKey | VXCYTMDMIPWIKM-UHFFFAOYSA-N |
| Molecular Weight | 396.612 g/mol |
| SMILES | C1(CCCCC1C(OCCCCCCCCCC)=O)C(=O)OCCCCCC |