| SpectraBase Spectrum ID |
8pWUZS8js9Y |
| Name |
Ethyl 1-[3,4-(methylenedioxy)phenyl]-3-formyl-4-hydroxy-6,7-dimethoxynaphthalene-2-carboxylate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
424.115817596 u |
| Formula |
C23H20O8 |
| InChI |
InChI=1S/C23H20O8/c1-4-29-23(26)21-15(10-24)22(25)14-9-18(28-3)17(27-2)8-13(14)20(21)12-5-6-16-19(7-12)31-11-30-16/h5-10,25H,4,11H2,1-3H3 |
| InChIKey |
FFXORCNDPLXMBH-UHFFFAOYSA-N |
| Molecular Weight |
424.405 g/mol |
| SMILES |
C=1(C(=C(C(=C2C=C(C(=CC12)OC)OC)O)C=O)C(=O)OCC)C=1C=C2C(=CC1)OCO2 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.819461 |
![Ethyl 1-[3,4-(methylenedioxy)phenyl]-3-formyl-4-hydroxy-6,7-dimethoxynaphthalene-2-carboxylate](/api/spectrum/8pWUZS8js9Y/structure.png?h=300&w=458 "Ethyl 1-[3,4-(methylenedioxy)phenyl]-3-formyl-4-hydroxy-6,7-dimethoxynaphthalene-2-carboxylate")
