| SpectraBase Spectrum ID |
BZdp8xdMRgU |
| Name |
Glutaric acid, but-2-en-1-yl ethyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
214.120509056 u |
| Formula |
C11H18O4 |
| InChI |
InChI=1S/C11H18O4/c1-3-5-9-15-11(13)8-6-7-10(12)14-4-2/h3,5H,4,6-9H2,1-2H3/b5-3+ |
| InChIKey |
IJTAMUYXLKCMNB-HWKANZROSA-N |
| Molecular Weight |
214.261 g/mol |
| SMILES |
C(CCC(OCC)=O)C(OC\C=C\C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.901217 |
