| SpectraBase Spectrum ID |
A4Ds3i3tvwd |
| Name |
Succinic acid, di(but-2-en-1-yl) ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
226.120509056 u |
| Formula |
C12H18O4 |
| InChI |
InChI=1S/C12H18O4/c1-3-5-9-15-11(13)7-8-12(14)16-10-6-4-2/h3-6H,7-10H2,1-2H3/b5-3+,6-4+ |
| InChIKey |
PUASBHVEXSYHGK-GGWOSOGESA-N |
| Molecular Weight |
226.272 g/mol |
| SMILES |
C(CC(OC\C=C\C)=O)C(OC\C=C\C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.97856 |
