SpectraBase Spectrum ID |
4WCE8JXVi2t |
Name |
Benzamide, N-cyclopropyl-4,5-difluoro-2-methyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
211.080870303 u |
Formula |
C11H11F2NO |
InChI |
InChI=1S/C11H11F2NO/c1-6-4-9(12)10(13)5-8(6)11(15)14-7-2-3-7/h4-5,7H,2-3H2,1H3,(H,14,15) |
InChIKey |
OCCBHVUQKNZEHH-UHFFFAOYSA-N |
Molecular Weight |
211.212 g/mol |
SMILES |
C(C1=CC(=C(C=C1C)F)F)(NC1CC1)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.906639 |