| SpectraBase Spectrum ID |
K6AP6yaU0p6 |
| Name |
3-(4-Nitrophenyl)-5-phenyl-3,4,8,9,10,10a-hexahydro-2H,5Hpyrimido[5,4-e]pyrrolo[1,2-c]pyrimidine-1,6-dione |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H19N5O4 |
| InChI |
InChI=1S/C21H19N5O4/c27-20-17-16-7-4-12-24(16)21(28)25(14-5-2-1-3-6-14)19(17)22-18(23-20)13-8-10-15(11-9-13)26(29)30/h1-3,5-6,8-11,16,18,22H,4,7,12H2,(H,23,27) |
| InChIKey |
CKWKACLVNMROJP-UHFFFAOYSA-N |
| Molecular Weight |
405.414 g/mol |
| SMILES |
N1C(C=2C3N(C(N(C2NC1c1ccc(N(=O)=O)cc1)c1ccccc1)=O)CCC3)=O |
| SPLASH |
splash10-0udi-0000900000-aeeea790a6b3860516f1 |
| Source of Spectrum |
F2-44-4581-9g |
| Wiley ID |
1705779 |
![3-(4-Nitrophenyl)-5-phenyl-3,4,8,9,10,10a-hexahydro-2H,5Hpyrimido[5,4-e]pyrrolo[1,2-c]pyrimidine-1,6-dione](/api/spectrum/K6AP6yaU0p6/structure.png?h=300&w=458 "3-(4-Nitrophenyl)-5-phenyl-3,4,8,9,10,10a-hexahydro-2H,5Hpyrimido[5,4-e]pyrrolo[1,2-c]pyrimidine-1,6-dione")
