SpectraBase Spectrum ID |
6O0o8JZQkZr |
Name |
alpha-Cyano-3,4-dimethoxycinnamamide |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
232.084792251 u |
Formula |
C12H12N2O3 |
InChI |
InChI=1S/C12H12N2O3/c1-16-10-4-3-8(6-11(10)17-2)5-9(7-13)12(14)15/h3-6H,1-2H3,(H2,14,15) |
InChIKey |
UHGNGGISEFEZHE-UHFFFAOYSA-N |
Molecular Weight |
232.239 g/mol |
SMILES |
NC(C(=CC1=CC=C(C(=C1)OC)OC)C#N)=O |
Spectrum/Structure Validation Score (Raman) |
0.733801 |