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1-benzyl-1-(3-{4-[3-(1-benzyl-1-piperidiniumyl)-1-propynyl]phenyl}-2-propynyl)piperidinium dichloride
SpectraBase Compound ID IUEizdA7n2T
InChI InChI=1S/C36H42N2.2ClH/c1-5-15-35(16-6-1)31-37(25-9-3-10-26-37)29-13-19-33-21-23-34(24-22-33)20-14-30-38(27-11-4-12-28-38)32-36-17-7-2-8-18-36;;/h1-2,5-8,15-18,21-24H,3-4,9-12,25-32H2;2*1H/q+2;;/p-2
InChIKey WUXGWLWSWOQOFQ-UHFFFAOYSA-L
Mol Weight 573.65 g/mol
Molecular Formula C36H42Cl2N2
Exact Mass 572.272505 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID xoMju4Topy
Name 1-benzyl-1-(3-{4-[3-(1-benzyl-1-piperidiniumyl)-1-propynyl]phenyl}-2-propynyl)piperidinium dichloride
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C36H42N2.2ClH/c1-5-15-35(16-6-1)31-37(25-9-3-10-26-37)29-13-19-33-21-23-34(24-22-33)20-14-30-38(27-11-4-12-28-38)32-36-17-7-2-8-18-36;;/h1-2,5-8,15-18,21-24H,3-4,9-12,25-32H2;2*1H/q+2;;/p-2
InChIKey WUXGWLWSWOQOFQ-UHFFFAOYSA-L
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_3067
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: 120094; Labnumber: MNL-199; VK_ID: VK-003068
Temperature 305 °C