| SpectraBase Spectrum ID |
GOgo0rWnKGG |
| Name |
Ethyl 2-[(4-hydroxy-2-oxo-2H-chromen-3-yl)(4-hydroxyphenyl)methyl]-3-oxobutanoate |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
396.120902977 u |
| Formula |
C22H20O7 |
| InChI |
InChI=1S/C22H20O7/c1-3-28-21(26)17(12(2)23)18(13-8-10-14(24)11-9-13)19-20(25)15-6-4-5-7-16(15)29-22(19)27/h4-11,17-18,24-25H,3H2,1-2H3 |
| InChIKey |
LJUVFUZXAXLULL-UHFFFAOYSA-N |
| Molecular Weight |
396.395 g/mol |
| SMILES |
C(C(C(C)=O)C(C=1C=CC(=CC1)O)C=1C(OC=2C=CC=CC2C1O)=O)(=O)OCC |
![Ethyl 2-[(4-hydroxy-2-oxo-2H-chromen-3-yl)(4-hydroxyphenyl)methyl]-3-oxobutanoate](/api/spectrum/GOgo0rWnKGG/structure.png?h=300&w=458 "Ethyl 2-[(4-hydroxy-2-oxo-2H-chromen-3-yl)(4-hydroxyphenyl)methyl]-3-oxobutanoate")
