SpectraBase Spectrum ID |
2sSNEQMeaaY |
Name |
Benzamide, 2,6-difluoro-3-methyl-N-(2-butyl)-N-(2-ethylhexyl)- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
339.237370947 u |
Formula |
C20H31F2NO |
InChI |
InChI=1S/C20H31F2NO/c1-6-9-10-16(8-3)13-23(15(5)7-2)20(24)18-17(21)12-11-14(4)19(18)22/h11-12,15-16H,6-10,13H2,1-5H3 |
InChIKey |
WHSIZLQINZKYKV-UHFFFAOYSA-N |
Molecular Weight |
339.471 g/mol |
SMILES |
C(N(C(CC)C)CC(CC)CCCC)(=O)C=1C(F)=C(C=CC1F)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.914114 |