| SpectraBase Spectrum ID |
5UFTgE2sg3p |
| Name |
5-Benzofuranpropanoic acid, 2,3-dihydro-3-[(4-methoxyphenyl)methylene]-2-oxo-, methyl ester, (E)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
338.115423675 u |
| Formula |
C20H18O5 |
| InChI |
InChI=1S/C20H18O5/c1-23-15-7-3-13(4-8-15)12-17-16-11-14(6-10-19(21)24-2)5-9-18(16)25-20(17)22/h3-5,7-9,11-12H,6,10H2,1-2H3/b17-12+ |
| InChIKey |
HGOMPJYFLJRXGY-SFQUDFHCSA-N |
| Molecular Weight |
338.359 g/mol |
| SMILES |
C1(\C(C=2C(O1)=CC=C(C2)CCC(=O)OC)=C\C=1C=CC(=CC1)OC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.962397 |
![5-Benzofuranpropanoic acid, 2,3-dihydro-3-[(4-methoxyphenyl)methylene]-2-oxo-, methyl ester, (E)-](/api/spectrum/5UFTgE2sg3p/structure.png?h=300&w=458 "5-Benzofuranpropanoic acid, 2,3-dihydro-3-[(4-methoxyphenyl)methylene]-2-oxo-, methyl ester, (E)-")
