| SpectraBase Spectrum ID |
LUQPDvD3KMm |
| Name |
Fumaric acid, eicosyl 3-heptyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
494.433510344 u |
| Formula |
C31H58O4 |
| InChI |
InChI=1S/C31H58O4/c1-4-7-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-28-34-30(32)26-27-31(33)35-29(6-3)25-8-5-2/h26-27,29H,4-25,28H2,1-3H3/b27-26+ |
| InChIKey |
WSEQFJATTAZGKE-CYYJNZCTSA-N |
| Molecular Weight |
494.801 g/mol |
| SMILES |
C(OC(CC)CCCC)(\C=C\C(OCCCCCCCCCCCCCCCCCCCC)=O)=O |
