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1-(3-methoxybenzyl)-4-(3-nitrobenzyl)piperazinediium oxalate

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1-(3-methoxybenzyl)-4-(3-nitrobenzyl)piperazinediium oxalate
SpectraBase Compound ID JGNLFSsWGOE
InChI InChI=1S/C19H23N3O3.C2H2O4/c1-25-19-7-3-5-17(13-19)15-21-10-8-20(9-11-21)14-16-4-2-6-18(12-16)22(23)24;3-1(4)2(5)6/h2-7,12-13H,8-11,14-15H2,1H3;(H,3,4)(H,5,6)
InChIKey XDKQBTGIHSJKFZ-UHFFFAOYSA-N
Mol Weight 431.45 g/mol
Molecular Formula C21H25N3O7
Exact Mass 431.16925 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID E6QNrXWR9gX
Name 1-(3-methoxybenzyl)-4-(3-nitrobenzyl)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/C19H23N3O3.C2H2O4/c1-25-19-7-3-5-17(13-19)15-21-10-8-20(9-11-21)14-16-4-2-6-18(12-16)22(23)24;3-1(4)2(5)6/h2-7,12-13H,8-11,14-15H2,1H3;(H,3,4)(H,5,6)
InChIKey XDKQBTGIHSJKFZ-UHFFFAOYSA-N
NMR Offset 16.5281
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_8457
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/9030807; UBI_ID: UBI-008460
Temperature 308 °C