SpectraBase Spectrum ID |
58exjVI4p61 |
Name |
Benzamide, N,N-dibutyl-2,6-difluoro- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
269.159120625 u |
Formula |
C15H21F2NO |
InChI |
InChI=1S/C15H21F2NO/c1-3-5-10-18(11-6-4-2)15(19)14-12(16)8-7-9-13(14)17/h7-9H,3-6,10-11H2,1-2H3 |
InChIKey |
BTXNGJCNHCDPDU-UHFFFAOYSA-N |
Molecular Weight |
269.336 g/mol |
SMILES |
C1=CC=C(C(=C1F)C(N(CCCC)CCCC)=O)F |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.935358 |