| SpectraBase Spectrum ID |
DVCzWhZNJTq |
| Name |
Benzamide, 3-fluoro-N-butyl-N-hept-2-yl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
293.215492688 u |
| Formula |
C18H28FNO |
| InChI |
InChI=1S/C18H28FNO/c1-4-6-8-10-15(3)20(13-7-5-2)18(21)16-11-9-12-17(19)14-16/h9,11-12,14-15H,4-8,10,13H2,1-3H3 |
| InChIKey |
JMSFUHWYRKFTKX-UHFFFAOYSA-N |
| Molecular Weight |
293.426 g/mol |
| SMILES |
C1=C(C=CC=C1F)C(N(C(CCCCC)C)CCCC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.877523 |
