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1-(1,4-Diphenylbut-3-yn-2-yl)piperidine

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

1-(1,4-Diphenylbut-3-yn-2-yl)piperidine
SpectraBase Compound ID F283agTUHXD
InChI InChI=1S/C21H23N/c1-4-10-19(11-5-1)14-15-21(22-16-8-3-9-17-22)18-20-12-6-2-7-13-20/h1-2,4-7,10-13,21H,3,8-9,16-18H2
InChIKey VNENBLDZSQARFD-UHFFFAOYSA-N
Mol Weight 289.42 g/mol
Molecular Formula C21H23N
Exact Mass 289.18305 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 85JSQEWO0Wl
Name 1-(1,4-Diphenylbut-3-yn-2-yl)piperidine
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 289.183049745 u
Formula C21H23N
InChI InChI=1S/C21H23N/c1-4-10-19(11-5-1)14-15-21(22-16-8-3-9-17-22)18-20-12-6-2-7-13-20/h1-2,4-7,10-13,21H,3,8-9,16-18H2
InChIKey VNENBLDZSQARFD-UHFFFAOYSA-N
Molecular Weight 289.422 g/mol
SMILES C(#CC1=CC=CC=C1)C(N1CCCCC1)CC1=CC=CC=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.939066