SpectraBase Spectrum ID |
AargwHgKMMj |
Name |
1-(2'-Methylphenyl)-4,6-dimethylpyrimidin-2-one |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
214.110613078 u |
Formula |
C13H14N2O |
InChI |
InChI=1S/C13H14N2O/c1-9-6-4-5-7-12(9)15-11(3)8-10(2)14-13(15)16/h4-8H,1-3H3 |
InChIKey |
MYFKKUSLCIQEOI-UHFFFAOYSA-N |
Molecular Weight |
214.268 g/mol |
SMILES |
C1(N(C(C)=CC(=N1)C)C=1C(C)=CC=CC1)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.947092 |