SpectraBase Spectrum ID |
K1NIHicH1JI |
Name |
Pyridine-3-carboxamide, N-(3-hydroxypropyl)- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
180.089877632 u |
Formula |
C9H12N2O2 |
InChI |
InChI=1S/C9H12N2O2/c12-6-2-5-11-9(13)8-3-1-4-10-7-8/h1,3-4,7,12H,2,5-6H2,(H,11,13) |
InChIKey |
DXFBTJMJKOUGFE-UHFFFAOYSA-N |
Molecular Weight |
180.207 g/mol |
SMILES |
C(C1=CN=CC=C1)(=O)NCCCO |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.846579 |