SpectraBase Spectrum ID |
AP0pky7WnyD |
Name |
Benzamide, N-tetrahydrofurfuryl-2,3,4,5,6-pentafluoro- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
295.063169379 u |
Formula |
C12H10F5NO2 |
InChI |
InChI=1S/C12H10F5NO2/c13-7-6(8(14)10(16)11(17)9(7)15)12(19)18-4-5-2-1-3-20-5/h5H,1-4H2,(H,18,19) |
InChIKey |
WGMMGDGLWHOERW-UHFFFAOYSA-N |
Molecular Weight |
295.209 g/mol |
SMILES |
C1(=C(C(=C(C(=C1F)C(NCC1CCCO1)=O)F)F)F)F |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.928074 |