| SpectraBase Spectrum ID |
6sWkhxjIa7M |
| Name |
Benzamide, 2,6-difluoro-3-methyl-N-(2-pentyl)-N-dodecyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
409.315621269 u |
| Formula |
C25H41F2NO |
| InChI |
InChI=1S/C25H41F2NO/c1-5-7-8-9-10-11-12-13-14-15-19-28(21(4)16-6-2)25(29)23-22(26)18-17-20(3)24(23)27/h17-18,21H,5-16,19H2,1-4H3 |
| InChIKey |
STFKZQFEQNQWQD-UHFFFAOYSA-N |
| Molecular Weight |
409.606 g/mol |
| SMILES |
C(C1=C(C(=CC=C1F)C)F)(N(CCCCCCCCCCCC)C(CCC)C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.886296 |
