| SpectraBase Spectrum ID |
3WJ6q25gXiB |
| Name |
Benzamide, 2,6-difluoro-3-methyl-N-(2-butyl)-N-nonyl- |
| 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/c1-5-7-8-9-10-11-12-15-24(17(4)6-2)21(25)19-18(22)14-13-16(3)20(19)23/h13-14,17H,5-12,15H2,1-4H3 |
| InChIKey |
LUQXNVSWDUNFCS-UHFFFAOYSA-N |
| Molecular Weight |
353.498 g/mol |
| SMILES |
C(N(C(CC)C)CCCCCCCCC)(=O)C=1C(F)=C(C=CC1F)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.80114 |
