| SpectraBase Spectrum ID |
HcZOPJBjCYu |
| Name |
Methyl 2-{[3-(3,4-dimethoxyphenyl)prop-2-enoyl](methyl)amino}benzoate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
355.141972775 u |
| Formula |
C20H21NO5 |
| InChI |
InChI=1S/C20H21NO5/c1-21(16-8-6-5-7-15(16)20(23)26-4)19(22)12-10-14-9-11-17(24-2)18(13-14)25-3/h5-13H,1-4H3/b12-10+ |
| InChIKey |
RLXJFVNIHFFKFP-ZRDIBKRKSA-N |
| Molecular Weight |
355.390 g/mol |
| SMILES |
COC1=C(OC)C=C(C=C1)\C=C\C(N(C1=C(C(OC)=O)C=CC=C1)C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.929563 |
amino}benzoate](/api/spectrum/HcZOPJBjCYu/structure.png?h=300&w=458 "Methyl 2-{[3-(3,4-dimethoxyphenyl)prop-2-enoyl](methyl)amino}benzoate")
