| SpectraBase Spectrum ID |
73Rbh2n46vi |
| Name |
Pyrimido[4,5-D]pyrimidine-2,4(1H,3H)-dione, 6,7-dihydro-1,3-dimethyl-7-[(4-methylphenyl)imino]-6-phenyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
373.153874870 u |
| Formula |
C21H19N5O2 |
| InChI |
InChI=1S/C21H19N5O2/c1-14-9-11-15(12-10-14)22-20-23-18-17(19(27)25(3)21(28)24(18)2)13-26(20)16-7-5-4-6-8-16/h4-13H,1-3H3/b22-20+ |
| InChIKey |
BURVCGFAXOJBLX-LSDHQDQOSA-N |
| Molecular Weight |
373.416 g/mol |
| SMILES |
C=12C(C(=O)N(C(N2C)=O)C)=CN(\C(N1)=N\C=1C=CC(=CC1)C)C1=CC=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.916777 |
![Pyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione, 6,7-dihydro-1,3-dimethyl-7-[(4-methylphenyl)imino]-6-phenyl-](/api/spectrum/73Rbh2n46vi/structure.png?h=300&w=458 "Pyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione, 6,7-dihydro-1,3-dimethyl-7-[(4-methylphenyl)imino]-6-phenyl-")
