SpectraBase Spectrum ID |
Jbcf5Ezpczr |
Name |
Benzamide, 3-methoxy-2,4,5-trifluoro-N-(2-butyl)-N-octyl- |
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/c1-5-7-8-9-10-11-12-24(14(3)6-2)20(25)15-13-16(21)18(23)19(26-4)17(15)22/h13-14H,5-12H2,1-4H3 |
InChIKey |
HZCGJUUEQDJYTO-UHFFFAOYSA-N |
Molecular Weight |
373.460 g/mol |
SMILES |
C(N(CCCCCCCC)C(CC)C)(=O)C=1C(F)=C(C(=C(F)C1)F)OC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.829303 |