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(m-hydroxyphenyl)trimethylammonium methyl sulfate, dimethylcarbamate

View entire compound with spectra: 4 NMR, and 1 FTIR

(m-hydroxyphenyl)trimethylammonium methyl sulfate, dimethylcarbamate
SpectraBase Compound ID HkSztNNylnN
InChI InChI=1S/C12H19N2O2.CH4O4S/c1-13(2)12(15)16-11-8-6-7-10(9-11)14(3,4)5;1-5-6(2,3)4/h6-9H,1-5H3;1H3,(H,2,3,4)/q+1;/p-1
InChIKey OSZNNLWOYWAHSS-UHFFFAOYSA-M
Mol Weight 334.39 g/mol
Molecular Formula C13H22N2O6S
Exact Mass 334.119858 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HXdtXpt2arP
Name Neostigmine methyl sulfate
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 286818
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H22N2O6S
InChI InChI=1S/C12H19N2O2.CH4O4S/c1-13(2)12(15)16-11-8-6-7-10(9-11)14(3,4)5;1-5-6(2,3)4/h6-9H,1-5H3;1H3,(H,2,3,4)/q+1;/p-1
InChIKey OSZNNLWOYWAHSS-UHFFFAOYSA-M
Molecular Weight 334.387 g/mol
Observed nucleus 1H
Purity 98%
Solvent CDCl3
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms 3-(N,N-Dimethylcarbamoyloxy)-N,N,N,-trimethylanilinium methyl sulfate
Wiley ID SIAL_1HNMR_013473