SpectraBase Spectrum ID |
Lhr6DqILoxS |
Name |
2-(2-Methoxy-2-phenyl-ethyl)malonic acid dimethyl ester |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
266.115423675 u |
Formula |
C14H18O5 |
InChI |
InChI=1S/C14H18O5/c1-17-12(10-7-5-4-6-8-10)9-11(13(15)18-2)14(16)19-3/h4-8,11-12H,9H2,1-3H3 |
InChIKey |
KIGONRRMWDVURM-UHFFFAOYSA-N |
Molecular Weight |
266.293 g/mol |
SMILES |
C(C(C(=O)OC)CC(C=1C=CC=CC1)OC)(=O)OC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.975296 |