| SpectraBase Spectrum ID |
9qjYk4IXlXW |
| Name |
Fumaric acid, di(2-decyl) ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
396.323959893 u |
| Formula |
C24H44O4 |
| InChI |
InChI=1S/C24H44O4/c1-5-7-9-11-13-15-17-21(3)27-23(25)19-20-24(26)28-22(4)18-16-14-12-10-8-6-2/h19-22H,5-18H2,1-4H3/b20-19+ |
| InChIKey |
JTBIRPAFIJUFMV-FMQUCBEESA-N |
| Molecular Weight |
396.612 g/mol |
| SMILES |
C(OC(CCCCCCCC)C)(\C=C\C(OC(CCCCCCCC)C)=O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.913877 |
