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N-(2-Fluorobenzyl)-3-phenylpropanamine

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

N-(2-Fluorobenzyl)-3-phenylpropanamine
SpectraBase Compound ID 2ijNka3vKKG
InChI InChI=1S/C16H18FN/c17-16-11-5-4-10-15(16)13-18-12-6-9-14-7-2-1-3-8-14/h1-5,7-8,10-11,18H,6,9,12-13H2
InChIKey IAKWFMGUIXAZKP-UHFFFAOYSA-N
Mol Weight 243.33 g/mol
Molecular Formula C16H18FN
Exact Mass 243.142328 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID LL3sJN6oSfi
Name N-(2-Fluorobenzyl)-3-phenylpropanamine
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 243.142327747 u
Formula C16H18FN
InChI InChI=1S/C16H18FN/c17-16-11-5-4-10-15(16)13-18-12-6-9-14-7-2-1-3-8-14/h1-5,7-8,10-11,18H,6,9,12-13H2
InChIKey IAKWFMGUIXAZKP-UHFFFAOYSA-N
Molecular Weight 243.325 g/mol
SMILES C=1(C(=CC=CC1)F)CNCCCC=1C=CC=CC1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.92625