SpectraBase Spectrum ID |
FJJJ702jEjf |
Name |
Benzamide, 3-fluoro-N-(2-butyl)-N-hexyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
279.199842623 u |
Formula |
C17H26FNO |
InChI |
InChI=1S/C17H26FNO/c1-4-6-7-8-12-19(14(3)5-2)17(20)15-10-9-11-16(18)13-15/h9-11,13-14H,4-8,12H2,1-3H3 |
InChIKey |
CSLLYKUBNSXLKK-UHFFFAOYSA-N |
Molecular Weight |
279.399 g/mol |
SMILES |
C1=CC=C(C=C1C(N(CCCCCC)C(CC)C)=O)F |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.92312 |