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N-((E)-(benzylsulfanyl){[(E)-1,1-dimethylethyl]imino}methyl)-4-methoxybenzenaminium bromide

View entire compound with spectra: 2 NMR

N-((E)-(benzylsulfanyl){[(E)-1,1-dimethylethyl]imino}methyl)-4-methoxybenzenaminium bromide
SpectraBase Compound ID 6HxTk7wrl8F
InChI InChI=1S/C19H24N2OS.BrH/c1-19(2,3)21-18(23-14-15-8-6-5-7-9-15)20-16-10-12-17(22-4)13-11-16;/h5-13H,14H2,1-4H3,(H,20,21);1H
InChIKey RYCAERUTJRBSAO-UHFFFAOYSA-N
Mol Weight 409.39 g/mol
Molecular Formula C19H25BrN2OS
Exact Mass 408.087098 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FqZ3zOqI46V
Name (Z)-2-benzyl-1-(tert-butyl)-3-(4-methoxyphenyl)isothiouronium bromide
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/C19H24N2OS.BrH/c1-19(2,3)21-18(23-14-15-8-6-5-7-9-15)20-16-10-12-17(22-4)13-11-16;/h5-13H,14H2,1-4H3,(H,20,21);1H
InChIKey RYCAERUTJRBSAO-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_20877
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/9315905; UBI_ID: UBI-020881
Temperature 308 °C