SpectraBase Spectrum ID |
GzCtlCzKYWA |
Name |
4'-Ethoxy-4-methoxy-2'-methylchalcone (isomer 2) |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
296.141244501 u |
Formula |
C19H20O3 |
InChI |
InChI=1S/C19H20O3/c1-4-22-17-10-11-18(14(2)13-17)19(20)12-7-15-5-8-16(21-3)9-6-15/h5-13H,4H2,1-3H3/b12-7+ |
InChIKey |
KBYZKWRTCKKDOX-KPKJPENVSA-N |
Molecular Weight |
296.366 g/mol |
SMILES |
C1(=C(C=C(C=C1)OCC)C)C(\C=C\C=1C=CC(OC)=CC1)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.957794 |