| SpectraBase Spectrum ID |
BRfgP40TpzZ |
| Name |
Pyrimidine-2,4,6(1H,3H,5H)-trione, 1-(4-methylphenyl)-5-(3-methylphenylaminomethylene)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
335.126991416 u |
| Formula |
C19H17N3O3 |
| InChI |
InChI=1S/C19H17N3O3/c1-12-6-8-15(9-7-12)22-18(24)16(17(23)21-19(22)25)11-20-14-5-3-4-13(2)10-14/h3-11,20H,1-2H3,(H,21,23,25)/b16-11+ |
| InChIKey |
PXFSVSAFIUNVFJ-LFIBNONCSA-N |
| Molecular Weight |
335.363 g/mol |
| SMILES |
CC1=CC=CC(=C1)N\C=C\1C(N(C(NC1=O)=O)C=1C=CC(C)=CC1)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.944624 |
