| SpectraBase Spectrum ID |
KMxgFKVOP5r |
| Name |
2'-(Acetyl)oxy-3,4,5,6'-tetramethoxychalcone |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
386.136553041 u |
| Formula |
C21H22O7 |
| InChI |
InChI=1S/C21H22O7/c1-13(22)28-17-8-6-7-16(24-2)20(17)15(23)10-9-14-11-18(25-3)21(27-5)19(12-14)26-4/h6-12H,1-5H3/b10-9+ |
| InChIKey |
KWDKUBJWZCSITP-MDZDMXLPSA-N |
| Molecular Weight |
386.400 g/mol |
| SMILES |
C1(=C(C=CC=C1OC(C)=O)OC)C(\C=C\C1=CC(=C(C(=C1)OC)OC)OC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.924187 |
