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(Ethoxycarbonylmethyl)dimethylsulfonium bromide

View entire compound with spectra: 2 NMR, and 1 FTIR

(Ethoxycarbonylmethyl)dimethylsulfonium bromide
SpectraBase Compound ID LYXcWERG5yp
InChI InChI=1S/C6H13O2S.BrH/c1-4-8-6(7)5-9(2)3;/h4-5H2,1-3H3;1H/q+1;/p-1
InChIKey JXFPTJYKYKVENJ-UHFFFAOYSA-M
Mol Weight 229.13 g/mol
Molecular Formula C6H13BrO2S
Exact Mass 227.981964 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JY7hqtIjzvf
Name (Ethoxycarbonylmethyl)dimethylsulfonium bromide
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 145262
CAS Registry Number 5187-82-6
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H13BrO2S
InChI InChI=1S/C6H13O2S.BrH/c1-4-8-6(7)5-9(2)3;/h4-5H2,1-3H3;1H/q+1;/p-1
InChIKey JXFPTJYKYKVENJ-UHFFFAOYSA-M
Observed nucleus 13C
Purity 97%
Solvent CDCl3
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms Carbethoxymethyl-dimethylsulfonium bromide (2-ethoxy-2-oxoethyl)dimethylsulfonium bromide
Wiley ID SIAL_13CNMR_001325