SpectraBase Spectrum ID |
1tkaS5xz5Y9 |
Name |
Benzamide, 2,6-difluoro-3-methyl-N-methyl-N-heptyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
283.174770690 u |
Formula |
C16H23F2NO |
InChI |
InChI=1S/C16H23F2NO/c1-4-5-6-7-8-11-19(3)16(20)14-13(17)10-9-12(2)15(14)18/h9-10H,4-8,11H2,1-3H3 |
InChIKey |
KKQLSGHVAITETR-UHFFFAOYSA-N |
Molecular Weight |
283.363 g/mol |
SMILES |
C1=CC(=C(C(=C1C)F)C(N(C)CCCCCCC)=O)F |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.817429 |