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1-(3-methylbenzyl)-4-(3-pyridinylmethyl)piperazinediium oxalate

View entire compound with spectra: 1 NMR

1-(3-methylbenzyl)-4-(3-pyridinylmethyl)piperazinediium oxalate
SpectraBase Compound ID JRsUCUEg3QW
InChI InChI=1S/C18H23N3.C2H2O4/c1-16-4-2-5-17(12-16)14-20-8-10-21(11-9-20)15-18-6-3-7-19-13-18;3-1(4)2(5)6/h2-7,12-13H,8-11,14-15H2,1H3;(H,3,4)(H,5,6)
InChIKey GBNAIEQRAAEWQY-UHFFFAOYSA-N
Mol Weight 371.44 g/mol
Molecular Formula C20H25N3O4
Exact Mass 371.184506 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID GV0Qromy6Tc
Name 1-(3-methylbenzyl)-4-(3-pyridinylmethyl)piperazinediium oxalate
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/C18H23N3.C2H2O4/c1-16-4-2-5-17(12-16)14-20-8-10-21(11-9-20)15-18-6-3-7-19-13-18;3-1(4)2(5)6/h2-7,12-13H,8-11,14-15H2,1H3;(H,3,4)(H,5,6)
InChIKey GBNAIEQRAAEWQY-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_12924
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/9029560; UBI_ID: UBI-012927
Temperature 318 °C