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(2-{[2-(dimethylammonio)ethyl]sulfanyl}ethyl)(dimethyl)ammonium bis(2-hydroxybenzoate)
SpectraBase Compound ID LIoTDttjoE2
InChI InChI=1S/C8H20N2S.2C7H6O3/c1-9(2)5-7-11-8-6-10(3)4;2*8-6-4-2-1-3-5(6)7(9)10/h5-8H2,1-4H3;2*1-4,8H,(H,9,10)
InChIKey PLDMGKLOGZPSHN-UHFFFAOYSA-N
Mol Weight 452.57 g/mol
Molecular Formula C22H32N2O6S
Exact Mass 452.198108 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DTUhit6iNH7
Name (2-{[2-(dimethylammonio)ethyl]sulfanyl}ethyl)(dimethyl)ammonium bis(2-hydroxybenzoate)
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/C8H20N2S.2C7H6O3/c1-9(2)5-7-11-8-6-10(3)4;2*8-6-4-2-1-3-5(6)7(9)10/h5-8H2,1-4H3;2*1-4,8H,(H,9,10)
InChIKey PLDMGKLOGZPSHN-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_16409
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: 987/00003786; Labnumber: 987/00003786218846; VK_ID: VK-016414
Temperature 318 °C