| SpectraBase Compound ID | 7TaGU54p8u2 |
|---|---|
| InChI | InChI=1S/C20H38O4/c1-5-7-8-9-10-11-12-13-14-15-16-17-24-19(22)20(3,4)18(21)23-6-2/h5-17H2,1-4H3 |
| InChIKey | SMCKZPQFSZGADZ-UHFFFAOYSA-N |
| Mol Weight | 342.5 g/mol |
| Molecular Formula | C20H38O4 |
| Exact Mass | 342.27701 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Htz6u15UFeK |
|---|---|
| Name | Dimethylmalonic acid, ethyl tridecyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 342.277009700 u |
| Formula | C20H38O4 |
| InChI | InChI=1S/C20H38O4/c1-5-7-8-9-10-11-12-13-14-15-16-17-24-19(22)20(3,4)18(21)23-6-2/h5-17H2,1-4H3 |
| InChIKey | SMCKZPQFSZGADZ-UHFFFAOYSA-N |
| Molecular Weight | 342.520 g/mol |
| SMILES | CCCCCCCCCCCCCOC(=O)C(C(OCC)=O)(C)C |