SpectraBase Spectrum ID |
CQhINzJo85T |
Name |
Benzamide, 2,6-difluoro-3-methyl-N-(2-pentyl)-N-undecyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
395.299971205 u |
Formula |
C24H39F2NO |
InChI |
InChI=1S/C24H39F2NO/c1-5-7-8-9-10-11-12-13-14-18-27(20(4)15-6-2)24(28)22-21(25)17-16-19(3)23(22)26/h16-17,20H,5-15,18H2,1-4H3 |
InChIKey |
PROKYXFUWIRRSB-UHFFFAOYSA-N |
Molecular Weight |
395.579 g/mol |
SMILES |
C(C1=C(C(=CC=C1F)C)F)(N(CCCCCCCCCCC)C(CCC)C)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.915134 |