| SpectraBase Spectrum ID |
CUAsZqSlI63 |
| Name |
1-(4-Methoxyphenyl)dodecane-1,2-dione |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
304.203844759 u |
| Formula |
C19H28O3 |
| InChI |
InChI=1S/C19H28O3/c1-3-4-5-6-7-8-9-10-11-18(20)19(21)16-12-14-17(22-2)15-13-16/h12-15H,3-11H2,1-2H3 |
| InChIKey |
RIXZMFUCLKLZMZ-UHFFFAOYSA-N |
| Molecular Weight |
304.430 g/mol |
| SMILES |
C(CCC(C(C=1C=CC(=CC1)OC)=O)=O)CCCCCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.85806 |
