| SpectraBase Spectrum ID |
1Pz86cc7Xuk |
| Name |
2-(2-Methylallyl)malonic acid diethyl 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/c1-5-14-10(12)9(7-8(3)4)11(13)15-6-2/h9H,3,5-7H2,1-2,4H3 |
| InChIKey |
XHPMGAMKZRNIIO-UHFFFAOYSA-N |
| Molecular Weight |
214.261 g/mol |
| SMILES |
C(C(=O)OCC)(C(=O)OCC)CC(=C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.979033 |
