| SpectraBase Spectrum ID |
5d9JgUV9oxy |
| Name |
N-(2-Chlorophenyl)-4-methyl-2-oxo-6-phenyl-3,6-dihydro-1H-pyrimidine-5-carboxamide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
341.093104465 u |
| Formula |
C18H16ClN3O2 |
| InChI |
InChI=1S/C18H16ClN3O2/c1-11-15(17(23)21-14-10-6-5-9-13(14)19)16(22-18(24)20-11)12-7-3-2-4-8-12/h2-10,16H,1H3,(H,21,23)(H2,20,22,24) |
| InChIKey |
PECOPIMZMVBIHH-UHFFFAOYSA-N |
| Molecular Weight |
341.798 g/mol |
| SMILES |
C1(NC(NC(=C1C(NC1=C(C=CC=C1)Cl)=O)C)=O)C=1C=CC=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.894289 |
