| SpectraBase Compound ID | Fn1aje3UH23 |
|---|---|
| InChI | InChI=1S/C14H24O4/c1-4-7-9-12(8-5-2)18-14(16)11-10-13(15)17-6-3/h10-12H,4-9H2,1-3H3/b11-10+ |
| InChIKey | BZPJBINKUUKKIQ-ZHACJKMWSA-N |
| Mol Weight | 256.34 g/mol |
| Molecular Formula | C14H24O4 |
| Exact Mass | 256.167459 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BmzrhmX2NPa |
|---|---|
| Name | Fumaric acid, ethyl 4-octyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 256.167459249 u |
| Formula | C14H24O4 |
| InChI | InChI=1S/C14H24O4/c1-4-7-9-12(8-5-2)18-14(16)11-10-13(15)17-6-3/h10-12H,4-9H2,1-3H3/b11-10+ |
| InChIKey | BZPJBINKUUKKIQ-ZHACJKMWSA-N |
| Molecular Weight | 256.342 g/mol |
| SMILES | CCOC(\C=C\C(OC(CCCC)CCC)=O)=O |