SpectraBase Spectrum ID |
GHZhUnAnAhp |
Name |
Benzamide, 2,3,4-trifluoro-N,N-dipropyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
259.118398627 u |
Formula |
C13H16F3NO |
InChI |
InChI=1S/C13H16F3NO/c1-3-7-17(8-4-2)13(18)9-5-6-10(14)12(16)11(9)15/h5-6H,3-4,7-8H2,1-2H3 |
InChIKey |
GURSHFVFVCPWKV-UHFFFAOYSA-N |
Molecular Weight |
259.272 g/mol |
SMILES |
C(C1=C(F)C(=C(C=C1)F)F)(N(CCC)CCC)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.834449 |