| SpectraBase Spectrum ID |
7kyHvx3mqT7 |
| Name |
2'-(2-Methylpropyl)oxy-4,4',6'-trimethoxychalcone (ISOMER2) |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
370.178023932 u |
| Formula |
C22H26O5 |
| InChI |
InChI=1S/C22H26O5/c1-15(2)14-27-21-13-18(25-4)12-20(26-5)22(21)19(23)11-8-16-6-9-17(24-3)10-7-16/h6-13,15H,14H2,1-5H3/b11-8+ |
| InChIKey |
XGZZDRHKXHUREP-DHZHZOJOSA-N |
| Molecular Weight |
370.445 g/mol |
| SMILES |
C1(=C(C=C(C=C1OC)OC)OCC(C)C)C(\C=C\C=1C=CC(OC)=CC1)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.963624 |
