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1-[(4-methylphenyl)sulfonyl]-4-(2-pyridinylmethyl)piperazin-4-ium

View entire compound with spectra: 1 NMR

1-[(4-methylphenyl)sulfonyl]-4-(2-pyridinylmethyl)piperazin-4-ium
SpectraBase Compound ID 4JGyUercZFH
InChI InChI=1S/C17H21N3O2S/c1-15-5-7-17(8-6-15)23(21,22)20-12-10-19(11-13-20)14-16-4-2-3-9-18-16/h2-9H,10-14H2,1H3/p+1
InChIKey YTZOVERPLNRHKY-UHFFFAOYSA-O
Mol Weight 332.44 g/mol
Molecular Formula C17H22N3O2S
Exact Mass 332.143273 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1yGkuamsC3I
Name 1-[(4-methylphenyl)sulfonyl]-4-(2-pyridinylmethyl)piperazin-4-ium
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/C17H21N3O2S/c1-15-5-7-17(8-6-15)23(21,22)20-12-10-19(11-13-20)14-16-4-2-3-9-18-16/h2-9H,10-14H2,1H3/p+1
InChIKey YTZOVERPLNRHKY-UHFFFAOYSA-O
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_20938
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/9319294; UBI_ID: UBI-020942
Temperature 318 °C