| SpectraBase Spectrum ID |
ByNgXJHyOv3 |
| Name |
Benzamide, 2,6-difluoro-3-methyl-N-(2-pentyl)-N-(3-methylbutyl)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
311.206070818 u |
| Formula |
C18H27F2NO |
| InChI |
InChI=1S/C18H27F2NO/c1-6-7-14(5)21(11-10-12(2)3)18(22)16-15(19)9-8-13(4)17(16)20/h8-9,12,14H,6-7,10-11H2,1-5H3 |
| InChIKey |
YHSJQQUQBRYOBE-UHFFFAOYSA-N |
| Molecular Weight |
311.417 g/mol |
| SMILES |
C(C1=C(C(=CC=C1F)C)F)(N(CCC(C)C)C(CCC)C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.887703 |
