SpectraBase Spectrum ID |
1RdbRjvEH3E |
Name |
2,4-Dimethoxy-2'-isopropyloxychalcone (isomer 2) |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
326.151809184 u |
Formula |
C20H22O4 |
InChI |
InChI=1S/C20H22O4/c1-14(2)24-19-8-6-5-7-17(19)18(21)12-10-15-9-11-16(22-3)13-20(15)23-4/h5-14H,1-4H3/b12-10+ |
InChIKey |
GQUCLULDVKGVCI-ZRDIBKRKSA-N |
Molecular Weight |
326.392 g/mol |
SMILES |
C1(=C(C=CC=C1)OC(C)C)C(\C=C\C=1C=CC(OC)=CC1OC)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.970601 |