SpectraBase Spectrum ID |
Cm5pFJPySkW |
Name |
1-(3-Fluoro-4-methoxybenzyl)-4-piperidinylamine, N-acetyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
280.158706085 u |
Formula |
C15H21FN2O2 |
InChI |
InChI=1S/C15H21FN2O2/c1-11(19)17-13-5-7-18(8-6-13)10-12-3-4-15(20-2)14(16)9-12/h3-4,9,13H,5-8,10H2,1-2H3,(H,17,19) |
InChIKey |
ZZLHZRSUSOMLBH-UHFFFAOYSA-N |
Molecular Weight |
280.343 g/mol |
SMILES |
C1(F)=C(C=CC(=C1)CN1CCC(CC1)NC(C)=O)OC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.975182 |