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N,N'-Dipentylbenzene-1,4-diamine

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

N,N'-Dipentylbenzene-1,4-diamine
SpectraBase Compound ID Bfh07WHdwF8
InChI InChI=1S/C16H28N2/c1-3-5-7-13-17-15-9-11-16(12-10-15)18-14-8-6-4-2/h9-12,17-18H,3-8,13-14H2,1-2H3
InChIKey KBZCJWFXUATLMS-UHFFFAOYSA-N
Mol Weight 248.41 g/mol
Molecular Formula C16H28N2
Exact Mass 248.225249 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID E5HO7i6bQR4
Name N,N'-Dipentylbenzene-1,4-diamine
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 248.225248910 u
Formula C16H28N2
InChI InChI=1S/C16H28N2/c1-3-5-7-13-17-15-9-11-16(12-10-15)18-14-8-6-4-2/h9-12,17-18H,3-8,13-14H2,1-2H3
InChIKey KBZCJWFXUATLMS-UHFFFAOYSA-N
Molecular Weight 248.414 g/mol
SMILES C=1C=C(C=CC1NCCCCC)NCCCCC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.957759