| SpectraBase Spectrum ID |
GcwwiEv2ATx |
| Name |
3-(2-Ketoethyl)-4-methyl-pent-4-enoic acid ethyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
184.109944372 u |
| Formula |
C10H16O3 |
| InChI |
InChI=1S/C10H16O3/c1-4-13-10(12)7-9(5-6-11)8(2)3/h6,9H,2,4-5,7H2,1,3H3 |
| InChIKey |
VFCKJXXRVYDCRE-UHFFFAOYSA-N |
| Molecular Weight |
184.235 g/mol |
| SMILES |
C(CC(CC=O)C(=C)C)(=O)OCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.902694 |
