| SpectraBase Spectrum ID |
4zcLIeI2oY0 |
| Name |
5'-Fluoro-2'-[(3-nitro-2-pyridyl)thio]acetanilide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
307.042690528 u |
| Formula |
C13H10FN3O3S |
| InChI |
InChI=1S/C13H10FN3O3S/c1-8(18)16-10-7-9(14)4-5-12(10)21-13-11(17(19)20)3-2-6-15-13/h2-7H,1H3,(H,16,18) |
| InChIKey |
YYAZIDGXFQOXDV-UHFFFAOYSA-N |
| Molecular Weight |
307.299 g/mol |
| SMILES |
N(C=1C=C(C=CC1SC1=NC=CC=C1N(=O)=O)F)C(=O)C |
| Spectrum/Structure Validation Score (Raman) |
0.936342 |
![5'-Fluoro-2'-[(3-nitro-2-pyridyl)thio]acetanilide](/api/spectrum/4zcLIeI2oY0/structure.png?h=300&w=458 "5'-Fluoro-2'-[(3-nitro-2-pyridyl)thio]acetanilide")
