| SpectraBase Spectrum ID |
Kir4ubdyDUh |
| Name |
2,4-Dimethoxy-2'-(2-butyl)oxychalcone (isomer 2) |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
340.167459249 u |
| Formula |
C21H24O4 |
| InChI |
InChI=1S/C21H24O4/c1-5-15(2)25-20-9-7-6-8-18(20)19(22)13-11-16-10-12-17(23-3)14-21(16)24-4/h6-15H,5H2,1-4H3/b13-11+ |
| InChIKey |
HJUOVUZHAHZCLE-ACCUITESSA-N |
| Molecular Weight |
340.419 g/mol |
| SMILES |
C1(=C(C=CC=C1)OC(CC)C)C(\C=C\C=1C=CC(OC)=CC1OC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.955234 |
