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2-Benzyl-(N,N'-bis(phenylacetyl)]-1,3-propandiamine

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

2-Benzyl-(N,N'-bis(phenylacetyl)]-1,3-propandiamine
SpectraBase Compound ID HgGXm5AFHun
InChI InChI=1S/C26H28N2O2/c29-25(17-22-12-6-2-7-13-22)27-19-24(16-21-10-4-1-5-11-21)20-28-26(30)18-23-14-8-3-9-15-23/h1-15,24H,16-20H2,(H,27,29)(H,28,30)
InChIKey XNGYADDUTBSRFL-UHFFFAOYSA-N
Mol Weight 400.52 g/mol
Molecular Formula C26H28N2O2
Exact Mass 400.215078 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID KYCfuExYo4W
Name 2-Benzyl-(N,N'-bis(phenylacetyl)]-1,3-propandiamine
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 400.215078148 u
Formula C26H28N2O2
InChI InChI=1S/C26H28N2O2/c29-25(17-22-12-6-2-7-13-22)27-19-24(16-21-10-4-1-5-11-21)20-28-26(30)18-23-14-8-3-9-15-23/h1-15,24H,16-20H2,(H,27,29)(H,28,30)
InChIKey XNGYADDUTBSRFL-UHFFFAOYSA-N
Molecular Weight 400.522 g/mol
SMILES C(NCC(CNC(=O)CC1=CC=CC=C1)CC1=CC=CC=C1)(=O)CC=1C=CC=CC1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.951754