SpectraBase Spectrum ID |
DXOJU5coiVe |
Name |
1-(Cyclohex-2-en-1-yl)-N-(3-fluorobenzyl)-N-methylmethanamine |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
233.157977811 u |
Formula |
C15H20FN |
InChI |
InChI=1S/C15H20FN/c1-17(11-13-6-3-2-4-7-13)12-14-8-5-9-15(16)10-14/h3,5-6,8-10,13H,2,4,7,11-12H2,1H3 |
InChIKey |
RDTVIRZEIVKOOX-UHFFFAOYSA-N |
Molecular Weight |
233.330 g/mol |
SMILES |
C=1(C=C(C=CC1)CN(CC1CCCC=C1)C)F |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.843844 |