| SpectraBase Spectrum ID |
F2Hep3vPqMB |
| Name |
Benzamide, 2,6-difluoro-N-(2-pentyl)-N-hexyl- |
| 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/c1-4-6-7-8-13-21(14(3)10-5-2)18(22)17-15(19)11-9-12-16(17)20/h9,11-12,14H,4-8,10,13H2,1-3H3 |
| InChIKey |
VHVNPDCRMMGGCQ-UHFFFAOYSA-N |
| Molecular Weight |
311.417 g/mol |
| SMILES |
C(=O)(N(CCCCCC)C(CCC)C)C1=C(C=CC=C1F)F |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.940435 |
