| SpectraBase Spectrum ID |
9p4jdzQ8dtH |
| Name |
3',4',5,6,7-Pentamethoxyflavanone |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
374.136553041 u |
| Formula |
C20H22O7 |
| InChI |
InChI=1S/C20H22O7/c1-22-13-7-6-11(8-15(13)23-2)14-9-12(21)18-16(27-14)10-17(24-3)19(25-4)20(18)26-5/h6-8,10,14H,9H2,1-5H3 |
| InChIKey |
HFKPIRGXRKMHJS-UHFFFAOYSA-N |
| Molecular Weight |
374.389 g/mol |
| SMILES |
C1(CC(=O)C=2C(O1)=CC(=C(C2OC)OC)OC)C1=CC(=C(C=C1)OC)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.974764 |
