![2-(2-pyridinylsulfanyl)-N-[3-(trifluoromethyl)phenyl]acetamide](/api/spectrum/Fny2vZNVrbS/structure.png?h=300&w=458 "2-(2-pyridinylsulfanyl)-N-[3-(trifluoromethyl)phenyl]acetamide")
| SpectraBase Compound ID | KoU3OFMgBPc |
|---|---|
| InChI | InChI=1S/C14H11F3N2OS/c15-14(16,17)10-4-3-5-11(8-10)19-12(20)9-21-13-6-1-2-7-18-13/h1-8H,9H2,(H,19,20) |
| InChIKey | JRDFGRRDZQNWAW-UHFFFAOYSA-N |
| Mol Weight | 312.31 g/mol |
| Molecular Formula | C14H11F3N2OS |
| Exact Mass | 312.054419 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Fny2vZNVrbS |
|---|---|
| Name | 2-(2-Pyridinylsulfanyl)-N-[3-(trifluoromethyl)phenyl]acetamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 312.054418644 u |
| Formula | C14H11F3N2OS |
| InChI | InChI=1S/C14H11F3N2OS/c15-14(16,17)10-4-3-5-11(8-10)19-12(20)9-21-13-6-1-2-7-18-13/h1-8H,9H2,(H,19,20) |
| InChIKey | JRDFGRRDZQNWAW-UHFFFAOYSA-N |
| Molecular Weight | 312.310 g/mol |
| SMILES | N(C(=O)CSC=1N=CC=CC1)C1=CC(C(F)(F)F)=CC=C1 |