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2-(4-methyl-2-sulfanylidene-3H-1,3-thiazol-5-yl)acetic acid

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2-(4-methyl-2-sulfanylidene-3H-1,3-thiazol-5-yl)acetic acid
SpectraBase Compound ID KCzD1VVky1Z
InChI InChI=1S/C6H7NO2S2/c1-3-4(2-5(8)9)11-6(10)7-3/h2H2,1H3,(H,7,10)(H,8,9)
InChIKey KYBOCQHDFLVQIB-UHFFFAOYSA-N
Mol Weight 189.25 g/mol
Molecular Formula C6H7NO2S2
Exact Mass 188.991821 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DPFIRKAjxRC
Name 2-Mercapto-4-methyl-5-thiazoleacetic acid
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 522317
CAS Registry Number 34272-64-5
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H7NO2S2
InChI InChI=1S/C6H7NO2S2/c1-3-4(2-5(8)9)11-6(10)7-3/h2H2,1H3,(H,7,10)(H,8,9)
InChIKey KYBOCQHDFLVQIB-UHFFFAOYSA-N
Observed nucleus 13C
Purity 98%
Solvent DMSO-d6
Source of Spectrum Sigma-Aldrich Co. LLC.
Wiley ID SIAL_13CNMR_010398