SpectraBase Spectrum ID |
FvKOt4Ee0nk |
Name |
N-Cinnamyl-2-fluoroaniline |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
227.111027618 u |
Formula |
C15H14FN |
InChI |
InChI=1S/C15H14FN/c16-14-10-4-5-11-15(14)17-12-6-9-13-7-2-1-3-8-13/h1-11,17H,12H2/b9-6+ |
InChIKey |
OZULCGDZZSCVMD-RMKNXTFCSA-N |
Molecular Weight |
227.282 g/mol |
SMILES |
C=1C(=C(C=CC1)F)NC\C=C\C1=CC=CC=C1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.924938 |