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1-(1,3-benzodioxol-5-ylmethyl)-4-(4-bromobenzyl)piperazine oxalate

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1-(1,3-benzodioxol-5-ylmethyl)-4-(4-bromobenzyl)piperazine oxalate
SpectraBase Compound ID J9H4UGnGYSd
InChI InChI=1S/C19H21BrN2O2.C2H2O4/c20-17-4-1-15(2-5-17)12-21-7-9-22(10-8-21)13-16-3-6-18-19(11-16)24-14-23-18;3-1(4)2(5)6/h1-6,11H,7-10,12-14H2;(H,3,4)(H,5,6)
InChIKey HJNOVPPVTNBPHD-UHFFFAOYSA-N
Mol Weight 479.33 g/mol
Molecular Formula C21H23BrN2O6
Exact Mass 478.073949 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8rS628YXkJw
Name 1-(1,3-benzodioxol-5-ylmethyl)-4-(4-bromobenzyl)piperazine 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/C19H21BrN2O2.C2H2O4/c20-17-4-1-15(2-5-17)12-21-7-9-22(10-8-21)13-16-3-6-18-19(11-16)24-14-23-18;3-1(4)2(5)6/h1-6,11H,7-10,12-14H2;(H,3,4)(H,5,6)
InChIKey HJNOVPPVTNBPHD-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_8174
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/9029619; UBI_ID: UBI-008177
Temperature 318 °C