| SpectraBase Spectrum ID |
AsVfDt77YOv |
| Name |
2'-(2-Methylpropyl)oxy-3,4,4'-trimethoxychalcone (isomer 2) |
| 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)14-27-21-13-17(24-3)8-9-18(21)19(23)10-6-16-7-11-20(25-4)22(12-16)26-5/h6-13,15H,14H2,1-5H3/b10-6+ |
| InChIKey |
WCVVSSHOGGMWCC-UXBLZVDNSA-N |
| Molecular Weight |
370.445 g/mol |
| SMILES |
C1(=C(C=C(C=C1)OC)OCC(C)C)C(\C=C\C=1C=CC(OC)=C(OC)C1)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.952159 |
