SpectraBase Spectrum ID |
4iKLwBp0AId |
Name |
(E)-3-(3,4-Dimethoxyphenyl)-1-[2,4,6-tris(methoxymethoxy)phenyl]-2-propen-1-one |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
448.173332473 u |
Formula |
C23H28O9 |
InChI |
InChI=1S/C23H28O9/c1-25-13-30-17-11-21(31-14-26-2)23(22(12-17)32-15-27-3)18(24)8-6-16-7-9-19(28-4)20(10-16)29-5/h6-12H,13-15H2,1-5H3/b8-6+ |
InChIKey |
MMUPVEDOVISREW-SOFGYWHQSA-N |
Molecular Weight |
448.468 g/mol |
SMILES |
C=1(C(=CC(=CC1OCOC)OCOC)OCOC)C(\C=C\C=1C=C(OC)C(=CC1)OC)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.970953 |