SpectraBase Spectrum ID |
1EceNh5AmGO |
Name |
N-(4-Dimethylaminophenyl)-3,5-difluorobenzothioamide |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
292.084575959 u |
Formula |
C15H14F2N2S |
InChI |
InChI=1S/C15H14F2N2S/c1-19(2)14-5-3-13(4-6-14)18-15(20)10-7-11(16)9-12(17)8-10/h3-9H,1-2H3,(H,18,20) |
InChIKey |
STKUMNJKNKJVBL-UHFFFAOYSA-N |
Molecular Weight |
292.348 g/mol |
SMILES |
C(C=1C=C(F)C=C(C1)F)(NC1=CC=C(C=C1)N(C)C)=S |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.900856 |