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1-(4-chlorobenzyl)-4-(3-pyridinylcarbonyl)piperazin-1-ium

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1-(4-chlorobenzyl)-4-(3-pyridinylcarbonyl)piperazin-1-ium
SpectraBase Compound ID BkAAoBxKPHw
InChI InChI=1S/C17H18ClN3O/c18-16-5-3-14(4-6-16)13-20-8-10-21(11-9-20)17(22)15-2-1-7-19-12-15/h1-7,12H,8-11,13H2/p+1
InChIKey YBSYTKIDBKNMGY-UHFFFAOYSA-O
Mol Weight 316.81 g/mol
Molecular Formula C17H19ClN3O
Exact Mass 316.121665 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8DBSIs1dDtp
Name 1-(4-chlorobenzyl)-4-(3-pyridinylcarbonyl)piperazin-1-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/C17H18ClN3O/c18-16-5-3-14(4-6-16)13-20-8-10-21(11-9-20)17(22)15-2-1-7-19-12-15/h1-7,12H,8-11,13H2/p+1
InChIKey YBSYTKIDBKNMGY-UHFFFAOYSA-O
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_20692
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/9311915; UBI_ID: UBI-020696
Temperature 308 °C