| SpectraBase Spectrum ID |
1s8gtuQ4SNs |
| Name |
6-Amino-5-(2,5-dioxo-1-phenylpyrrolidin-3-yl)pyrimidine-2,4(1H,3H)-dione |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
300.085854878 u |
| Formula |
C14H12N4O4 |
| InChI |
InChI=1S/C14H12N4O4/c15-11-10(12(20)17-14(22)16-11)8-6-9(19)18(13(8)21)7-4-2-1-3-5-7/h1-5,8H,6H2,(H4,15,16,17,20,22) |
| InChIKey |
KPZBWOKKBBWAGC-UHFFFAOYSA-N |
| Molecular Weight |
300.274 g/mol |
| SMILES |
C1(=C(NC(NC1=O)=O)N)C1C(N(C2=CC=CC=C2)C(C1)=O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.983262 |
