SpectraBase Spectrum ID |
1yA3PLiHjCR |
Name |
2-Propenoic acid, 3-(4-ethoxy-3,5-dimethoxyphenyl)-, ethyl ester |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
280.131073739 u |
Formula |
C15H20O5 |
InChI |
InChI=1S/C15H20O5/c1-5-19-14(16)8-7-11-9-12(17-3)15(20-6-2)13(10-11)18-4/h7-10H,5-6H2,1-4H3/b8-7+ |
InChIKey |
OPAIXYIBCPAMEV-BQYQJAHWSA-N |
SMILES |
C(OC1=C(OC)C=C(C=C1OC)\C=C\C(OCC)=O)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.800466 |