| SpectraBase Spectrum ID |
D2c3gknhnTq |
| Name |
Benzamide, 3-fluoro-5-trifluoromethyl-N-(2-pentyl)-N-undecyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
431.281127466 u |
| Formula |
C24H37F4NO |
| InChI |
InChI=1S/C24H37F4NO/c1-4-6-7-8-9-10-11-12-13-15-29(19(3)14-5-2)23(30)20-16-21(24(26,27)28)18-22(25)17-20/h16-19H,4-15H2,1-3H3 |
| InChIKey |
YYRNOPMABGTRDD-UHFFFAOYSA-N |
| Molecular Weight |
431.560 g/mol |
| SMILES |
C(C1=CC(=CC(=C1)C(F)(F)F)F)(N(CCCCCCCCCCC)C(CCC)C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.836098 |
