| SpectraBase Compound ID | D8TNxyYZWKN |
|---|---|
| InChI | InChI=1S/C19H32O4/c1-3-5-7-8-9-10-11-13-17-23-19(21)15-14-18(20)22-16-12-6-4-2/h9-10,14-15H,3-8,11-13,16-17H2,1-2H3/b10-9+,15-14+ |
| InChIKey | UJUMBRGHJAFKHF-ZNGCIPOTSA-N |
| Mol Weight | 324.5 g/mol |
| Molecular Formula | C19H32O4 |
| Exact Mass | 324.23006 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | tyZqj7r580 |
|---|---|
| Name | Fumaric acid, dec-4-enyl pentyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 324.230059506 u |
| Formula | C19H32O4 |
| InChI | InChI=1S/C19H32O4/c1-3-5-7-8-9-10-11-13-17-23-19(21)15-14-18(20)22-16-12-6-4-2/h9-10,14-15H,3-8,11-13,16-17H2,1-2H3/b10-9+,15-14+ |
| InChIKey | UJUMBRGHJAFKHF-ZNGCIPOTSA-N |
| Molecular Weight | 324.461 g/mol |
| SMILES | C(OCCC\C=C\CCCCC)(\C=C\C(OCCCCC)=O)=O |