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(diaminomethylene)[4-{[(diaminomethylene)sulfonio]methyl}-2,5-bis(methoxycarbonyl)benzyl]sulfonium dibromide
SpectraBase Compound ID DZ241oAnNow
InChI InChI=1S/C14H20N4O4S2.2BrH/c1-21-11(19)9-3-8(6-24-14(17)18)10(12(20)22-2)4-7(9)5-23-13(15)16;;/h3-4H,5-6,15-18H2,1-2H3;2*1H/q+2;;/p-2
InChIKey GNPKABQYGMLCMD-UHFFFAOYSA-L
Mol Weight 532.266 g/mol
Molecular Formula C14H20Br2N4O4S2
Exact Mass 529.929273 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HUmO9fJOJ7A
Name (diaminomethylene)[4-{[(diaminomethylene)sulfonio]methyl}-2,5-bis(methoxycarbonyl)benzyl]sulfonium 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/C14H20N4O4S2.2BrH/c1-21-11(19)9-3-8(6-24-14(17)18)10(12(20)22-2)4-7(9)5-23-13(15)16;;/h3-4H,5-6,15-18H2,1-2H3;2*1H/q+2;;/p-2
InChIKey GNPKABQYGMLCMD-UHFFFAOYSA-L
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_15753
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: 987/00002570; Labnumber: 987/00002570218830; VK_ID: VK-015758
Temperature 308 °C