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2-Acetamido-3-(methylthio)propanoic acid
SpectraBase Compound ID D9seOwL7Yn5
InChI InChI=1S/C6H11NO3S/c1-4(8)7-5(3-11-2)6(9)10/h5H,3H2,1-2H3,(H,7,8)(H,9,10)
InChIKey RYGLCORNOFFGTB-UHFFFAOYSA-N
Mol Weight 177.22 g/mol
Molecular Formula C6H11NO3S
Exact Mass 177.045964 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6yWwnZ9QEbp
Name 2-Acetamido-3-(methylthio)propanoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H11NO3S
InChI InChI=1S/C6H11NO3S/c1-4(8)7-5(3-11-2)6(9)10/h5H,3H2,1-2H3,(H,7,8)(H,9,10)
InChIKey RYGLCORNOFFGTB-UHFFFAOYSA-N
Molecular Weight 177.218 g/mol
SMILES OC(C(NC(=O)C)CSC)=O
SPLASH splash10-03xu-9400000000-fc74054f32a650281841
Source of Spectrum KO-22-137-0
Synonyms 2-Acetamido-3-(methylthio)propionic acid 2-Acetamido-3-methylsulfanyl-propanoic acid Methylmercapturic acid
Wiley ID 747117