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1-(4-methylpiperazin-4-ium-1-yl)isoquinolinium dibromide

View entire compound with spectra: 1 NMR

1-(4-methylpiperazin-4-ium-1-yl)isoquinolinium dibromide
SpectraBase Compound ID Esd3HNXLXAb
InChI InChI=1S/C14H17N3.2BrH/c1-16-8-10-17(11-9-16)14-13-5-3-2-4-12(13)6-7-15-14;;/h2-7H,8-11H2,1H3;2*1H
InChIKey UTILKXYSYHQMEQ-UHFFFAOYSA-N
Mol Weight 389.135 g/mol
Molecular Formula C14H19Br2N3
Exact Mass 386.994574 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID J67sitl57Vi
Name 1-(4-methylpiperazin-4-ium-1-yl)isoquinolinium dibromide
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/C14H17N3.2BrH/c1-16-8-10-17(11-9-16)14-13-5-3-2-4-12(13)6-7-15-14;;/h2-7H,8-11H2,1H3;2*1H
InChIKey UTILKXYSYHQMEQ-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_15623
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: 987/00002315; Labnumber: 987/00002315218827; VK_ID: VK-015628
Temperature 318 °C