| SpectraBase Compound ID | 9dDjtlecUnI |
|---|---|
| InChI | InChI=1S/C11H18O4/c1-3-5-6-9-15-11(13)8-7-10(12)14-4-2/h7-8H,3-6,9H2,1-2H3/b8-7+ |
| InChIKey | WZOPWGDHKKJMEA-BQYQJAHWSA-N |
| Mol Weight | 214.26 g/mol |
| Molecular Formula | C11H18O4 |
| Exact Mass | 214.120509 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DaPZcxGe3YL |
|---|---|
| Name | Fumaric acid, ethyl pentyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 214.120509056 u |
| Formula | C11H18O4 |
| InChI | InChI=1S/C11H18O4/c1-3-5-6-9-15-11(13)8-7-10(12)14-4-2/h7-8H,3-6,9H2,1-2H3/b8-7+ |
| InChIKey | WZOPWGDHKKJMEA-BQYQJAHWSA-N |
| Molecular Weight | 214.261 g/mol |
| SMILES | CCOC(\C=C\C(OCCCCC)=O)=O |