SpectraBase Spectrum ID |
1VeimejLgRC |
Name |
Benzamide, 4-trifluoromethyl-N-(2-butyl)-N-pentyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
315.180998885 u |
Formula |
C17H24F3NO |
InChI |
InChI=1S/C17H24F3NO/c1-4-6-7-12-21(13(3)5-2)16(22)14-8-10-15(11-9-14)17(18,19)20/h8-11,13H,4-7,12H2,1-3H3 |
InChIKey |
DYFASJLHJCLYNN-UHFFFAOYSA-N |
Molecular Weight |
315.380 g/mol |
SMILES |
C1=C(C=CC(=C1)C(F)(F)F)C(=O)N(CCCCC)C(CC)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.88187 |