| SpectraBase Spectrum ID |
2qY3cD9bdNC |
| Name |
Fumaric acid, di(pent-4-en-2-yl) ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
252.136159120 u |
| Formula |
C14H20O4 |
| InChI |
InChI=1S/C14H20O4/c1-5-7-11(3)17-13(15)9-10-14(16)18-12(4)8-6-2/h5-6,9-12H,1-2,7-8H2,3-4H3/b10-9+ |
| InChIKey |
ONSTWLLKVJJSQB-MDZDMXLPSA-N |
| Molecular Weight |
252.310 g/mol |
| SMILES |
C=CCC(OC(\C=C\C(OC(C)CC=C)=O)=O)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.985274 |
