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2,2'-(ethane-1,2-diyl)bis(3,4,5,6-tetrahydropyrimidin-1-ium) 4-methylbenzenesulfonate

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2,2'-(ethane-1,2-diyl)bis(3,4,5,6-tetrahydropyrimidin-1-ium) 4-methylbenzenesulfonate
SpectraBase Compound ID 3gHdL9aofD3
InChI InChI=1S/C10H18N4.2C7H8O3S/c1-5-11-9(12-6-1)3-4-10-13-7-2-8-14-10;2*1-6-2-4-7(5-3-6)11(8,9)10/h1-8H2,(H,11,12)(H,13,14);2*2-5H,1H3,(H,8,9,10)
InChIKey FGXXRUYRBSMBDM-UHFFFAOYSA-N
Mol Weight 538.68 g/mol
Molecular Formula C24H34N4O6S2
Exact Mass 538.191977 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JMBY9wkUOBu
Name 2,2'-(ethane-1,2-diyl)bis(3,4,5,6-tetrahydropyrimidin-1-ium) 4-methylbenzenesulfonate
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/C10H18N4.2C7H8O3S/c1-5-11-9(12-6-1)3-4-10-13-7-2-8-14-10;2*1-6-2-4-7(5-3-6)11(8,9)10/h1-8H2,(H,11,12)(H,13,14);2*2-5H,1H3,(H,8,9,10)
InChIKey FGXXRUYRBSMBDM-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_18012
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: 987/00006570; Labnumber: 987/00006570218880; VK_ID: VK-018019
Temperature 318 °C