SpectraBase Spectrum ID |
DapDaVRc9Sy |
Name |
1-Benzhydrilpyrimidine-2,4,6-trione |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
294.100442316 u |
Formula |
C17H14N2O3 |
InChI |
InChI=1S/C17H14N2O3/c20-14-11-15(21)19(17(22)18-14)16(12-7-3-1-4-8-12)13-9-5-2-6-10-13/h1-10,16H,11H2,(H,18,20,22) |
InChIKey |
JTGQVUBBMOQJIG-UHFFFAOYSA-N |
Molecular Weight |
294.310 g/mol |
SMILES |
C1(N(C(NC(C1)=O)=O)C(C1=CC=CC=C1)C1=CC=CC=C1)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.940454 |