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N-(4-N,N-Diethylbut-2-yn-1-yl)-3-methylaniline

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

N-(4-N,N-Diethylbut-2-yn-1-yl)-3-methylaniline
SpectraBase Compound ID KnV2jbt0O1Q
InChI InChI=1S/C15H22N2/c1-4-17(5-2)12-7-6-11-16-15-10-8-9-14(3)13-15/h8-10,13,16H,4-5,11-12H2,1-3H3
InChIKey JPHSXKHYVPNTGD-UHFFFAOYSA-N
Mol Weight 230.35 g/mol
Molecular Formula C15H22N2
Exact Mass 230.178299 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 25CKaInB82W
Name N-(4-N,N-Diethylbut-2-yn-1-yl)-3-methylaniline
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 230.178298716 u
Formula C15H22N2
InChI InChI=1S/C15H22N2/c1-4-17(5-2)12-7-6-11-16-15-10-8-9-14(3)13-15/h8-10,13,16H,4-5,11-12H2,1-3H3
InChIKey JPHSXKHYVPNTGD-UHFFFAOYSA-N
Molecular Weight 230.355 g/mol
SMILES C(#CCNC=1C=C(C)C=CC1)CN(CC)CC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.833694