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N-(2-oxo-1-Pentylazepan-3-yl)-2-phenylacetamide

View entire compound with spectra: 1 NMR, and 1 FTIR

N-(2-oxo-1-Pentylazepan-3-yl)-2-phenylacetamide
SpectraBase Compound ID 737MyJtqRfZ
InChI InChI=1S/C19H28N2O2/c1-2-3-8-13-21-14-9-7-12-17(19(21)23)20-18(22)15-16-10-5-4-6-11-16/h4-6,10-11,17H,2-3,7-9,12-15H2,1H3,(H,20,22)
InChIKey SDLOFOWHUNATJL-UHFFFAOYSA-N
Mol Weight 316.45 g/mol
Molecular Formula C19H28N2O2
Exact Mass 316.215078 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 9TR6qy80rzR
Name N-(2-oxo-1-Pentylazepan-3-yl)-2-phenylacetamide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 316.215078148 u
Formula C19H28N2O2
InChI InChI=1S/C19H28N2O2/c1-2-3-8-13-21-14-9-7-12-17(19(21)23)20-18(22)15-16-10-5-4-6-11-16/h4-6,10-11,17H,2-3,7-9,12-15H2,1H3,(H,20,22)
InChIKey SDLOFOWHUNATJL-UHFFFAOYSA-N
Molecular Weight 316.445 g/mol
SMILES C(CC1=CC=CC=C1)(=O)NC1C(N(CCCC1)CCCCC)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.958677