SpectraBase Spectrum ID |
CMQ4bmWaun7 |
Name |
Trans-4-ethoxy-3',4'-dimethoxychalcone |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
312.136159120 u |
Formula |
C19H20O4 |
InChI |
InChI=1S/C19H20O4/c1-4-23-16-9-5-14(6-10-16)7-11-17(20)15-8-12-18(21-2)19(13-15)22-3/h5-13H,4H2,1-3H3/b11-7+ |
InChIKey |
FBLJKAQSLLTBRQ-YRNVUSSQSA-N |
Molecular Weight |
312.365 g/mol |
SMILES |
C1(=CC=C(C(=C1)OC)OC)C(\C=C\C1=CC=C(C=C1)OCC)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.953503 |