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1-azoniabicyclo[2.2.2]octane, 2-[[4-(phenylmethoxy)phenyl]methyl]-, chloride
SpectraBase Compound ID 5qR8p18BpEf
InChI InChI=1S/C21H25NO.ClH/c1-2-4-19(5-3-1)16-23-21-8-6-17(7-9-21)14-20-15-18-10-12-22(20)13-11-18;/h1-9,18,20H,10-16H2;1H
InChIKey XQSKKAHWELLGMC-UHFFFAOYSA-N
Mol Weight 343.9 g/mol
Molecular Formula C21H26ClNO
Exact Mass 343.170292 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1RaNRxDX1JA
Name 1-azoniabicyclo[2.2.2]octane, 2-[[4-(phenylmethoxy)phenyl]methyl]-, chloride
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/C21H25NO.ClH/c1-2-4-19(5-3-1)16-23-21-8-6-17(7-9-21)14-20-15-18-10-12-22(20)13-11-18;/h1-9,18,20H,10-16H2;1H
InChIKey XQSKKAHWELLGMC-UHFFFAOYSA-N
NMR Offset 17.9892
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_8313_4015
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: NMR/16217858; Labnumber: A2800/0118362