| SpectraBase Compound ID | IZwNSGTnatj |
|---|---|
| InChI | InChI=1S/C14H26O4/c1-5-7-8-9-10-11-18-13(16)14(3,4)12(15)17-6-2/h5-11H2,1-4H3 |
| InChIKey | MXPXVDMNLAXXEA-UHFFFAOYSA-N |
| Mol Weight | 258.36 g/mol |
| Molecular Formula | C14H26O4 |
| Exact Mass | 258.183109 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 | WW8EB6n0tL |
|---|---|
| Name | Dimethylmalonic acid, ethyl heptyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 258.183109313 u |
| Formula | C14H26O4 |
| InChI | InChI=1S/C14H26O4/c1-5-7-8-9-10-11-18-13(16)14(3,4)12(15)17-6-2/h5-11H2,1-4H3 |
| InChIKey | MXPXVDMNLAXXEA-UHFFFAOYSA-N |
| Molecular Weight | 258.358 g/mol |
| SMILES | CCCCCCCOC(=O)C(C)(C)C(OCC)=O |