SpectraBase Spectrum ID |
K56njgqM28i |
Name |
4,6'-Dimethoxy-2'-(acetyl)oxychalcone |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
326.115423675 u |
Formula |
C19H18O5 |
InChI |
InChI=1S/C19H18O5/c1-13(20)24-18-6-4-5-17(23-3)19(18)16(21)12-9-14-7-10-15(22-2)11-8-14/h4-12H,1-3H3/b12-9+ |
InChIKey |
UPPFWONRFDLSAS-FMIVXFBMSA-N |
Molecular Weight |
326.348 g/mol |
SMILES |
C1(=C(C=CC=C1OC(C)=O)OC)C(\C=C\C1=CC=C(C=C1)OC)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.90888 |