| SpectraBase Compound ID | GykCjxegI8G |
|---|---|
| InChI | InChI=1S/C23H36O4/c1-5-7-8-9-10-11-12-13-17-26-21(24)23(3,4)22(25)27-20-16-14-15-19(6-2)18-20/h14-16,18H,5-13,17H2,1-4H3 |
| InChIKey | BWVPPXJPJPCPFX-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 | 5sUZYhhBao7 |
|---|---|
| Name | Dimethylmalonic acid, decyl 3-ethylphenyl 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/c1-5-7-8-9-10-11-12-13-17-26-21(24)23(3,4)22(25)27-20-16-14-15-19(6-2)18-20/h14-16,18H,5-13,17H2,1-4H3 |
| InChIKey | BWVPPXJPJPCPFX-UHFFFAOYSA-N |
| Molecular Weight | 376.537 g/mol |
| SMILES | CCC1=CC=CC(=C1)OC(C(C(OCCCCCCCCCC)=O)(C)C)=O |