| SpectraBase Spectrum ID |
45YGeA4xe79 |
| Name |
Pyrimidine-2,4,6(1H,3H,5H)-trione, 1-(2-fluorophenyl)-5-(2-methylphenylaminomethylene)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
339.101919483 u |
| Formula |
C18H14FN3O3 |
| InChI |
InChI=1S/C18H14FN3O3/c1-11-6-2-4-8-14(11)20-10-12-16(23)21-18(25)22(17(12)24)15-9-5-3-7-13(15)19/h2-10,20H,1H3,(H,21,23,25)/b12-10+ |
| InChIKey |
OGJUKYHORSJQJU-ZRDIBKRKSA-N |
| Molecular Weight |
339.326 g/mol |
| SMILES |
C1=CC=C(C(=C1)N\C=C\1C(N(C(NC1=O)=O)C=1C(=CC=CC1)F)=O)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.851645 |
