| SpectraBase Spectrum ID |
6q5ZjugM13h |
| Name |
2,3-Difluoro-6-(pyridin-2-yl)benzonitrile |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
216.049904527 u |
| Formula |
C12H6F2N2 |
| InChI |
InChI=1S/C12H6F2N2/c13-10-5-4-8(9(7-15)12(10)14)11-3-1-2-6-16-11/h1-6H |
| InChIKey |
FSIYJJFTMLWMIF-UHFFFAOYSA-N |
| Molecular Weight |
216.191 g/mol |
| SMILES |
C=1C=CN=C(C1)C=1C(=C(C(=CC1)F)F)C#N |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.954917 |
