| SpectraBase Spectrum ID |
JAbs8MW7WtI |
| Name |
2',4'-Dihydroxy-2,3-dimethoxychalcone, 2-methylpropionate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
440.183503235 u |
| Formula |
C25H28O7 |
| InChI |
InChI=1S/C25H28O7/c1-15(2)24(27)31-18-11-12-19(22(14-18)32-25(28)16(3)4)20(26)13-10-17-8-7-9-21(29-5)23(17)30-6/h7-16H,1-6H3/b13-10+ |
| InChIKey |
CCHUGVHOELBEJS-JLHYYAGUSA-N |
| Molecular Weight |
440.492 g/mol |
| SMILES |
C1(=CC=C(C=C1OC(C(C)C)=O)OC(C(C)C)=O)C(\C=C\C1=CC=CC(=C1OC)OC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.844227 |
