| SpectraBase Spectrum ID |
BDYSV3pnzC1 |
| Name |
3-Fluoro-6-trifluoromethylbenzamide, N,N-di(2-ethylhexyl)- |
| 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/c1-5-9-11-18(7-3)16-29(17-19(8-4)12-10-6-2)23(30)21-15-20(25)13-14-22(21)24(26,27)28/h13-15,18-19H,5-12,16-17H2,1-4H3 |
| InChIKey |
AZKKDGMWSBOOPB-UHFFFAOYSA-N |
| Molecular Weight |
431.560 g/mol |
| SMILES |
CCCCC(CC)CN(C(C1=C(C(F)(F)F)C=CC(=C1)F)=O)CC(CCCC)CC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.837465 |
