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N-(2,4-Dimethoxybenzyl)-1-phenylpent-1-yn-3-amine

View entire compound with spectra: 1 FTIR

N-(2,4-Dimethoxybenzyl)-1-phenylpent-1-yn-3-amine
SpectraBase Compound ID 2ubIfKlbffP
InChI InChI=1S/C20H23NO2/c1-4-18(12-10-16-8-6-5-7-9-16)21-15-17-11-13-19(22-2)14-20(17)23-3/h5-9,11,13-14,18,21H,4,15H2,1-3H3
InChIKey OMUNYTMVXFMYMH-UHFFFAOYSA-N
Mol Weight 309.41 g/mol
Molecular Formula C20H23NO2
Exact Mass 309.172879 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID Zq0AU7bWm4
Name N-(2,4-Dimethoxybenzyl)-1-phenylpent-1-yn-3-amine
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 309.172878983 u
Formula C20H23NO2
InChI InChI=1S/C20H23NO2/c1-4-18(12-10-16-8-6-5-7-9-16)21-15-17-11-13-19(22-2)14-20(17)23-3/h5-9,11,13-14,18,21H,4,15H2,1-3H3
InChIKey OMUNYTMVXFMYMH-UHFFFAOYSA-N
Molecular Weight 309.409 g/mol
SMILES C(#CC(CC)NCC1=C(C=C(C=C1)OC)OC)C1=CC=CC=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.871003