| SpectraBase Compound ID | Kxt9zlM2RwR |
|---|---|
| InChI | InChI=1S/C16H28O4/c1-4-6-7-8-9-10-11-14(3)20-16(18)13-12-15(17)19-5-2/h12-14H,4-11H2,1-3H3/b13-12+ |
| InChIKey | RMUGYXZVCWKTIZ-OUKQBFOZSA-N |
| Mol Weight | 284.4 g/mol |
| Molecular Formula | C16H28O4 |
| Exact Mass | 284.198759 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LImxAtfT0X6 |
|---|---|
| Name | Fumaric acid, 2-decyl ethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 284.198759378 u |
| Formula | C16H28O4 |
| InChI | InChI=1S/C16H28O4/c1-4-6-7-8-9-10-11-14(3)20-16(18)13-12-15(17)19-5-2/h12-14H,4-11H2,1-3H3/b13-12+ |
| InChIKey | RMUGYXZVCWKTIZ-OUKQBFOZSA-N |
| SMILES | C(OC(CCCCCCCC)C)(\C=C\C(OCC)=O)=O |