SpectraBase Spectrum ID |
8YwYTKNjtBn |
Name |
7-(4-Nitrophenyl)-8-(phenylcarbonyl)-2,3,6,7-tetrahydro-1H-imidazo[1,2-A]pyridin-5-one |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
363.121906035 u |
Formula |
C20H17N3O4 |
InChI |
InChI=1S/C20H17N3O4/c24-17-12-16(13-6-8-15(9-7-13)23(26)27)18(20-21-10-11-22(17)20)19(25)14-4-2-1-3-5-14/h1-9,16,21H,10-12H2 |
InChIKey |
ADZQDTDWXFHMLE-UHFFFAOYSA-N |
Molecular Weight |
363.373 g/mol |
SMILES |
C1(=C2N(CCN2)C(CC1C1=CC=C(N(=O)=O)C=C1)=O)C(=O)C1=CC=CC=C1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.812822 |