| SpectraBase Spectrum ID |
CDKYRap4Z4p |
| Name |
1,6-bis(4-Methoxyphenyl)hexane-1,6-dione |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
326.151809184 u |
| Formula |
C20H22O4 |
| InChI |
InChI=1S/C20H22O4/c1-23-17-11-7-15(8-12-17)19(21)5-3-4-6-20(22)16-9-13-18(24-2)14-10-16/h7-14H,3-6H2,1-2H3 |
| InChIKey |
JQRBVENMUYHRHT-UHFFFAOYSA-N |
| Molecular Weight |
326.392 g/mol |
| SMILES |
c1(ccc(cc1)C(=O)CCCCC(=O)c1ccc(cc1)OC)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.941931 |
