| SpectraBase Compound ID | Ev6bgXQmysU |
|---|---|
| InChI | InChI=1S/C16H26O4/c1-2-3-8-13-19-15(17)11-12-16(18)20-14-9-6-4-5-7-10-14/h11-12,14H,2-10,13H2,1H3/b12-11+ |
| InChIKey | WZBMWORZTYDYKC-VAWYXSNFSA-N |
| Mol Weight | 282.38 g/mol |
| Molecular Formula | C16H26O4 |
| Exact Mass | 282.183109 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 | 2f7sdeknRpl |
|---|---|
| Name | Fumaric acid, cycloheptyl pentyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 282.183109313 u |
| Formula | C16H26O4 |
| InChI | InChI=1S/C16H26O4/c1-2-3-8-13-19-15(17)11-12-16(18)20-14-9-6-4-5-7-10-14/h11-12,14H,2-10,13H2,1H3/b12-11+ |
| InChIKey | WZBMWORZTYDYKC-VAWYXSNFSA-N |
| SMILES | C1C(CCCCC1)OC(\C=C\C(OCCCCC)=O)=O |