SpectraBase Spectrum ID |
Fx76eoK4qSW |
Name |
Pyridine-2-carboxylic acid, (2-amino-phenyl)-amide |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
213.090211985 u |
Formula |
C12H11N3O |
InChI |
InChI=1S/C12H11N3O/c13-9-5-1-2-6-10(9)15-12(16)11-7-3-4-8-14-11/h1-8H,13H2,(H,15,16) |
InChIKey |
XIQCXQUJFNTCCK-UHFFFAOYSA-N |
Molecular Weight |
213.240 g/mol |
SMILES |
C(NC1=C(N)C=CC=C1)(C1=NC=CC=C1)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.950557 |