| SpectraBase Spectrum ID |
57GmmLQAA8v |
| Name |
2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-(3-chloro-2-hydroxypropyl)-1,3-dimethyl-5-phenyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
324.087684731 u |
| Formula |
C15H17ClN2O4 |
| InChI |
InChI=1S/C15H17ClN2O4/c1-17-12(20)15(8-11(19)9-16,10-6-4-3-5-7-10)13(21)18(2)14(17)22/h3-7,11,19H,8-9H2,1-2H3 |
| InChIKey |
PSTOCVBRBTTXRI-UHFFFAOYSA-N |
| Molecular Weight |
324.764 g/mol |
| SMILES |
C(CC1(C(=O)N(C)C(N(C1=O)C)=O)C1=CC=CC=C1)(CCl)O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.87825 |
