| SpectraBase Spectrum ID |
Hi2YYuTq04B |
| Name |
Benzamide, 2,6-difluoro-3-methyl-N-(2-pentyl)-N-(2-ethylhexyl)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
353.253021012 u |
| Formula |
C21H33F2NO |
| InChI |
InChI=1S/C21H33F2NO/c1-6-9-11-17(8-3)14-24(16(5)10-7-2)21(25)19-18(22)13-12-15(4)20(19)23/h12-13,16-17H,6-11,14H2,1-5H3 |
| InChIKey |
ONCDOOHPNHCHIS-UHFFFAOYSA-N |
| Molecular Weight |
353.498 g/mol |
| SMILES |
C(C1=C(C(=CC=C1F)C)F)(N(CC(CCCC)CC)C(CCC)C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.943548 |
