| SpectraBase Spectrum ID |
LchbYQrOn88 |
| Name |
2-(2H-1,3-Benzodioxol-5-ylmethylidene)-7-[(dimethylamino)methyl]-6-hydroxy-1-benzofuran-3-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
339.110672646 u |
| Formula |
C19H17NO5 |
| InChI |
InChI=1S/C19H17NO5/c1-20(2)9-13-14(21)5-4-12-18(22)17(25-19(12)13)8-11-3-6-15-16(7-11)24-10-23-15/h3-8,21H,9-10H2,1-2H3/b17-8+ |
| InChIKey |
IIJIMZPTGXYAEX-CAOOACKPSA-N |
| Molecular Weight |
339.347 g/mol |
| SMILES |
C1=2O\C(=C\C3=CC=4OCOC4C=C3)C(C1=CC=C(C2CN(C)C)O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.924164 |
![2-(2H-1,3-Benzodioxol-5-ylmethylidene)-7-[(dimethylamino)methyl]-6-hydroxy-1-benzofuran-3-one](/api/spectrum/LchbYQrOn88/structure.png?h=300&w=458 "2-(2H-1,3-Benzodioxol-5-ylmethylidene)-7-[(dimethylamino)methyl]-6-hydroxy-1-benzofuran-3-one")
