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2-Acetamido-3-(methylthio)propanoic acid methyl ester
SpectraBase Compound ID 6e1trQ6K4Jg
InChI InChI=1S/C7H13NO3S/c1-5(9)8-6(4-12-3)7(10)11-2/h6H,4H2,1-3H3,(H,8,9)
InChIKey PVZMIVQODTYDBQ-UHFFFAOYSA-N
Mol Weight 191.24 g/mol
Molecular Formula C7H13NO3S
Exact Mass 191.061614 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JTdPOoTlHTc
Name 2-Acetamido-3-(methylthio)propanoic acid methyl ester
Alternate Name(s) 2-Acetamido-3-(methylthio)propionic acid methyl ester Methyl 2-acetamido-3-methylsulfanyl-propanoate
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Formula C7H13NO3S
InChI InChI=1S/C7H13NO3S/c1-5(9)8-6(4-12-3)7(10)11-2/h6H,4H2,1-3H3,(H,8,9)
InChIKey PVZMIVQODTYDBQ-UHFFFAOYSA-N
Molecular Weight 191.245 g/mol
SMILES N(C(C(=O)OC)CSC)C(=O)C
SPLASH splash10-001i-0900000000-b97dd71ffc65e0fd3e30
Source of Spectrum D8-323-963-0
Wiley ID 1513823