SpectraBase Spectrum ID |
JswNUPPHx4q |
Name |
(E)-1-(3,4-Dimethoxyphenyl)-3-(4-methylphenyl)-2-propen-1-one |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
282.125594437 u |
Formula |
C18H18O3 |
InChI |
InChI=1S/C18H18O3/c1-13-4-6-14(7-5-13)8-10-16(19)15-9-11-17(20-2)18(12-15)21-3/h4-12H,1-3H3/b10-8+ |
InChIKey |
MBFUXAKECSBERE-CSKARUKUSA-N |
SMILES |
C(\C=C\C=1C=CC(=CC1)C)(C=1C=C(OC)C(=CC1)OC)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.957989 |