| SpectraBase Spectrum ID |
27g5Dy7cK7H |
| Name |
Benzamide, 2,6-difluoro-3-methyl-N-(2-pentyl)-N-pentyl- |
| 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/c1-5-7-8-12-21(14(4)9-6-2)18(22)16-15(19)11-10-13(3)17(16)20/h10-11,14H,5-9,12H2,1-4H3 |
| InChIKey |
HFBDNDKNPGPYGH-UHFFFAOYSA-N |
| Molecular Weight |
311.417 g/mol |
| SMILES |
C(C1=C(C(=CC=C1F)C)F)(N(CCCCC)C(CCC)C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.929176 |
