| SpectraBase Spectrum ID |
1ejfgIWpABN |
| Name |
4',6'-Dimethoxy-4-dimethylamino-2'-(acetyl)oxychalcone (isomer 1) |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
369.157622840 u |
| Formula |
C21H23NO5 |
| InChI |
InChI=1S/C21H23NO5/c1-14(23)27-20-13-17(25-4)12-19(26-5)21(20)18(24)11-8-15-6-9-16(10-7-15)22(2)3/h6-13H,1-5H3/b11-8+ |
| InChIKey |
LVOUXXPUEXPTDU-DHZHZOJOSA-N |
| Molecular Weight |
369.417 g/mol |
| SMILES |
C1(=C(C=C(C=C1OC)OC)OC(C)=O)C(\C=C\C=1C=CC(N(C)C)=CC1)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.961949 |
