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N-(4-aminophenethyl)octanamide

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

N-(4-aminophenethyl)octanamide
SpectraBase Compound ID AO8nF4iXaGz
InChI InChI=1S/C16H26N2O/c1-2-3-4-5-6-7-16(19)18-13-12-14-8-10-15(17)11-9-14/h8-11H,2-7,12-13,17H2,1H3,(H,18,19)
InChIKey IXGHJFJPVMVUFZ-UHFFFAOYSA-N
Mol Weight 262.4 g/mol
Molecular Formula C16H26N2O
Exact Mass 262.204513 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 2xS9Za7Lj9o
Name N-(4-Aminophenethyl)octanamide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 262.204513464 u
Formula C16H26N2O
InChI InChI=1S/C16H26N2O/c1-2-3-4-5-6-7-16(19)18-13-12-14-8-10-15(17)11-9-14/h8-11H,2-7,12-13,17H2,1H3,(H,18,19)
InChIKey IXGHJFJPVMVUFZ-UHFFFAOYSA-N
Molecular Weight 262.397 g/mol
SMILES CCCCCCCC(=O)NCCC1=CC=C(C=C1)N
Spectrum/Structure Validation Score (Vapor Phase IR) 0.868232