SpectraBase Spectrum ID |
AGfyhSdlgrU |
Name |
4-Chlorobenzoic acid(1-pyridin-2-ylethylidene)-hydrazide |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
273.066889717 u |
Formula |
C14H12ClN3O |
InChI |
InChI=1S/C14H12ClN3O/c1-10(13-4-2-3-9-16-13)17-18-14(19)11-5-7-12(15)8-6-11/h2-9H,1H3,(H,18,19)/b17-10+ |
InChIKey |
BRPAABKVWTVIPX-LICLKQGHSA-N |
SMILES |
C1(=NC=CC=C1)\C(=N\NC(C1=CC=C(Cl)C=C1)=O)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.817001 |