SpectraBase Spectrum ID |
ASB7VYHRmn |
Name |
2'-Hydroxy-3,3',4,4',5',6'-hexamethoxy-chalcone |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
404.147117725 u |
Formula |
C21H24O8 |
InChI |
InChI=1S/C21H24O8/c1-24-14-10-8-12(11-15(14)25-2)7-9-13(22)16-17(23)19(27-4)21(29-6)20(28-5)18(16)26-3/h7-11,23H,1-6H3/b9-7+ |
InChIKey |
YJWMUOUYEWHGFK-VQHVLOKHSA-N |
Molecular Weight |
404.415 g/mol |
SMILES |
C(\C=C\C1=CC(=C(C=C1)OC)OC)(=O)C1=C(C(=C(C(=C1O)OC)OC)OC)OC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.92671 |