SpectraBase Spectrum ID |
3EF6V4oV6lO |
Name |
(2-Fluorophenyl)-(1-phenylbut-3-enyl)amine |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
241.126677682 u |
Formula |
C16H16FN |
InChI |
InChI=1S/C16H16FN/c1-2-8-15(13-9-4-3-5-10-13)18-16-12-7-6-11-14(16)17/h2-7,9-12,15,18H,1,8H2 |
InChIKey |
ZHFHDFZZJJRGPE-UHFFFAOYSA-N |
Molecular Weight |
241.309 g/mol |
SMILES |
C(NC=1C(=CC=CC1)F)(CC=C)C=1C=CC=CC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.887342 |