| SpectraBase Compound ID | CxklQu2jRnL |
|---|---|
| InChI | InChI=1S/C16H24O4/c1-3-5-7-9-13-19-15(17)11-12-16(18)20-14-10-8-6-4-2/h5-8,11-12H,3-4,9-10,13-14H2,1-2H3/b7-5+,8-6+,12-11+ |
| InChIKey | QGNBTOILRVTESN-UXJRKJCUSA-N |
| Mol Weight | 280.36 g/mol |
| Molecular Formula | C16H24O4 |
| Exact Mass | 280.167459 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 | JKT2Iig9Qam |
|---|---|
| Name | Fumaric acid, di(trans-hex-3-enyl) ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 280.167459249 u |
| Formula | C16H24O4 |
| InChI | InChI=1S/C16H24O4/c1-3-5-7-9-13-19-15(17)11-12-16(18)20-14-10-8-6-4-2/h5-8,11-12H,3-4,9-10,13-14H2,1-2H3/b7-5+,8-6+,12-11+ |
| InChIKey | QGNBTOILRVTESN-UXJRKJCUSA-N |
| SMILES | C(OCC\C=C\CC)(\C=C\C(OCC\C=C\CC)=O)=O |