| SpectraBase Spectrum ID |
3kq3iaijRJr |
| Name |
Benzamide, 3,4-difluoro-N-butyl-N-(2-ethylhexyl)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
325.221720883 u |
| Formula |
C19H29F2NO |
| InChI |
InChI=1S/C19H29F2NO/c1-4-7-9-15(6-3)14-22(12-8-5-2)19(23)16-10-11-17(20)18(21)13-16/h10-11,13,15H,4-9,12,14H2,1-3H3 |
| InChIKey |
CQBKQUPYESORRN-UHFFFAOYSA-N |
| Molecular Weight |
325.444 g/mol |
| SMILES |
C1(=CC=C(C=C1F)C(N(CC(CCCC)CC)CCCC)=O)F |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.95344 |
