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1-benzyl-4-{[2-(3,4-dimethoxyphenyl)ethyl]ammonio}piperidinium
SpectraBase Compound ID 3LxTQkWgYBs
InChI InChI=1S/C22H30N2O2/c1-25-21-9-8-18(16-22(21)26-2)10-13-23-20-11-14-24(15-12-20)17-19-6-4-3-5-7-19/h3-9,16,20,23H,10-15,17H2,1-2H3/p+2
InChIKey IAPZOQVPRJPFDJ-UHFFFAOYSA-P
Mol Weight 356.5 g/mol
Molecular Formula C22H32N2O2
Exact Mass 356.246378 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CmMSkNMixzN
Name 1-benzyl-4-{[2-(3,4-dimethoxyphenyl)ethyl]ammonio}piperidinium
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/C22H30N2O2/c1-25-21-9-8-18(16-22(21)26-2)10-13-23-20-11-14-24(15-12-20)17-19-6-4-3-5-7-19/h3-9,16,20,23H,10-15,17H2,1-2H3/p+2
InChIKey IAPZOQVPRJPFDJ-UHFFFAOYSA-P
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_13637
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: UZI/9311046; UBI_ID: UBI-013640
Temperature 308 °C