SpectraBase Spectrum ID |
K7JGcgo5IpD |
Name |
Benzamide, 2,4-difluoro-N-butyl-N-nonyl- |
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/c1-3-5-7-8-9-10-11-15-23(14-6-4-2)20(24)18-13-12-17(21)16-19(18)22/h12-13,16H,3-11,14-15H2,1-2H3 |
InChIKey |
VZJMDOVGYFUGSA-UHFFFAOYSA-N |
Molecular Weight |
339.471 g/mol |
SMILES |
C1(=CC=C(C(=C1)F)C(N(CCCCCCCCC)CCCC)=O)F |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.855269 |