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1-(3-bromobenzyl)-4-(3,5-dimethoxybenzoyl)piperazin-1-ium

View entire compound with spectra: 1 NMR

1-(3-bromobenzyl)-4-(3,5-dimethoxybenzoyl)piperazin-1-ium
SpectraBase Compound ID ITMIGyswZ2F
InChI InChI=1S/C20H23BrN2O3/c1-25-18-11-16(12-19(13-18)26-2)20(24)23-8-6-22(7-9-23)14-15-4-3-5-17(21)10-15/h3-5,10-13H,6-9,14H2,1-2H3/p+1
InChIKey SACCPERDIALFMV-UHFFFAOYSA-O
Mol Weight 420.33 g/mol
Molecular Formula C20H24BrN2O3
Exact Mass 419.097031 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DNwYMns3Uk6
Name 1-(3-bromobenzyl)-4-(3,5-dimethoxybenzoyl)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/C20H23BrN2O3/c1-25-18-11-16(12-19(13-18)26-2)20(24)23-8-6-22(7-9-23)14-15-4-3-5-17(21)10-15/h3-5,10-13H,6-9,14H2,1-2H3/p+1
InChIKey SACCPERDIALFMV-UHFFFAOYSA-O
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_13675
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/9311305; UBI_ID: UBI-013678
Temperature 318 °C