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1-cycloheptyl-4-(3,4,5-trimethoxybenzyl)piperazinediium

View entire compound with spectra: 1 NMR

1-cycloheptyl-4-(3,4,5-trimethoxybenzyl)piperazinediium
SpectraBase Compound ID 29sfDYUufxW
InChI InChI=1S/C21H34N2O3/c1-24-19-14-17(15-20(25-2)21(19)26-3)16-22-10-12-23(13-11-22)18-8-6-4-5-7-9-18/h14-15,18H,4-13,16H2,1-3H3/p+2
InChIKey REOWSLHEUNEEDO-UHFFFAOYSA-P
Mol Weight 364.5 g/mol
Molecular Formula C21H36N2O3
Exact Mass 364.272593 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7QFJNspuw2Y
Name 1-cycloheptyl-4-(3,4,5-trimethoxybenzyl)piperazinediium
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/C21H34N2O3/c1-24-19-14-17(15-20(25-2)21(19)26-3)16-22-10-12-23(13-11-22)18-8-6-4-5-7-9-18/h14-15,18H,4-13,16H2,1-3H3/p+2
InChIKey REOWSLHEUNEEDO-UHFFFAOYSA-P
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_13771
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/9312078; UBI_ID: UBI-013774
Temperature 308 °C