| SpectraBase Spectrum ID |
1wzQ4JGcTVA |
| Name |
N,N-Diethylphenylthiodifluoroacetamide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
259.084241606 u |
| Formula |
C12H15F2NOS |
| InChI |
InChI=1S/C12H15F2NOS/c1-3-15(4-2)11(16)12(13,14)17-10-8-6-5-7-9-10/h5-9H,3-4H2,1-2H3 |
| InChIKey |
AWXCASYPKHZPOO-UHFFFAOYSA-N |
| Molecular Weight |
259.315 g/mol |
| SMILES |
C(C(=O)N(CC)CC)(SC1=CC=CC=C1)(F)F |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.926169 |
