| SpectraBase Compound ID | E76a3ST2vU6 |
|---|---|
| InChI | InChI=1S/C25H48O5/c1-5-8-9-10-11-12-13-14-15-16-17-18-19-20-29-23(26)25(6-2,7-3)24(27)30-22-21-28-4/h5-22H2,1-4H3 |
| InChIKey | LERXEBBODFOSDM-UHFFFAOYSA-N |
| Mol Weight | 428.7 g/mol |
| Molecular Formula | C25H48O5 |
| Exact Mass | 428.350175 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7l9vNCxQj8w |
|---|---|
| Name | Diethylmalonic acid, 2-methoxyethyl pentadecyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 428.350174641 u |
| Formula | C25H48O5 |
| InChI | InChI=1S/C25H48O5/c1-5-8-9-10-11-12-13-14-15-16-17-18-19-20-29-23(26)25(6-2,7-3)24(27)30-22-21-28-4/h5-22H2,1-4H3 |
| InChIKey | LERXEBBODFOSDM-UHFFFAOYSA-N |
| Molecular Weight | 428.654 g/mol |
| SMILES | C(C(C(OCCCCCCCCCCCCCCC)=O)(CC)CC)(OCCOC)=O |