SpectraBase Spectrum ID |
9LPDG9QGF5Q |
Name |
Diethyl 2-(2-methoxyethyl)-2-allylmalonate |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
258.146723803 u |
Formula |
C13H22O5 |
InChI |
InChI=1S/C13H22O5/c1-5-8-13(9-10-16-4,11(14)17-6-2)12(15)18-7-3/h5H,1,6-10H2,2-4H3 |
InChIKey |
BEURPHQLBCBKBA-UHFFFAOYSA-N |
Molecular Weight |
258.314 g/mol |
SMILES |
C(C(=O)OCC)(C(=O)OCC)(CC=C)CCOC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.929149 |