SpectraBase Spectrum ID |
5O2KTto7nnp |
Name |
5-Phenyl-3,10-dimethylpyrimido[4,5-B]quinoline-2,4(3H,10H)-dione |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
317.116426733 u |
Formula |
C19H15N3O2 |
InChI |
InChI=1S/C19H15N3O2/c1-21-14-11-7-6-10-13(14)15(12-8-4-3-5-9-12)16-17(21)20-19(24)22(2)18(16)23/h3-11H,1-2H3 |
InChIKey |
UQBNMUQKLGIVMF-UHFFFAOYSA-N |
Molecular Weight |
317.348 g/mol |
SMILES |
C=12N(C=3C=CC=CC3C(=C2C(N(C(N1)=O)C)=O)C=1C=CC=CC1)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.951856 |