SpectraBase Spectrum ID |
6FOT65gaUIT |
Name |
Benzamide, 2,3,4-trifluoro-N-methallyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
229.071448434 u |
Formula |
C11H10F3NO |
InChI |
InChI=1S/C11H10F3NO/c1-6(2)5-15-11(16)7-3-4-8(12)10(14)9(7)13/h3-4H,1,5H2,2H3,(H,15,16) |
InChIKey |
HWZNQTQKMAELFS-UHFFFAOYSA-N |
Molecular Weight |
229.202 g/mol |
SMILES |
C(C1=C(C(=C(C=C1)F)F)F)(=O)NCC(=C)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.850409 |