SpectraBase Spectrum ID |
5AxbYm3j6Nj |
Name |
Benzamide, 2,6-difluoro-3-methyl-N-ethyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
199.080870303 u |
Formula |
C10H11F2NO |
InChI |
InChI=1S/C10H11F2NO/c1-3-13-10(14)8-7(11)5-4-6(2)9(8)12/h4-5H,3H2,1-2H3,(H,13,14) |
InChIKey |
JMAOLOBHOJLICX-UHFFFAOYSA-N |
Molecular Weight |
199.201 g/mol |
SMILES |
C(NCC)(=O)C=1C(F)=CC=C(C)C1F |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.923364 |