SpectraBase Spectrum ID |
6PCMvqcQG2x |
Name |
Benzamide, 2,4,5-trifluoro-3-methoxy-N-butyl-N-(2-ethylhexyl)- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
373.222863697 u |
Formula |
C20H30F3NO2 |
InChI |
InChI=1S/C20H30F3NO2/c1-5-8-10-14(7-3)13-24(11-9-6-2)20(25)15-12-16(21)18(23)19(26-4)17(15)22/h12,14H,5-11,13H2,1-4H3 |
InChIKey |
PPHPAXQSENNLAX-UHFFFAOYSA-N |
Molecular Weight |
373.460 g/mol |
SMILES |
C1(=C(C=C(C(=C1OC)F)C(N(CC(CCCC)CC)CCCC)=O)F)F |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.949721 |