SpectraBase Spectrum ID |
EwyvtZ5HVtp |
Name |
Benzamide, 2,5-di(trifluoromethyl)-N-methyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
271.043182826 u |
Formula |
C10H7F6NO |
InChI |
InChI=1S/C10H7F6NO/c1-17-8(18)6-4-5(9(11,12)13)2-3-7(6)10(14,15)16/h2-4H,1H3,(H,17,18) |
InChIKey |
VKHJXQJUDHLTPD-UHFFFAOYSA-N |
Molecular Weight |
271.162 g/mol |
SMILES |
C(NC)(=O)C=1C=C(C=CC1C(F)(F)F)C(F)(F)F |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.812325 |