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3-(methylthio)propionic acid, methyl ester
SpectraBase Compound ID 7vCj2R8rhmT
InChI InChI=1S/C5H10O2S/c1-7-5(6)3-4-8-2/h3-4H2,1-2H3
InChIKey DMMJVMYCBULSIS-UHFFFAOYSA-N
Mol Weight 134.19 g/mol
Molecular Formula C5H10O2S
Exact Mass 134.040151 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID WxXMkUgXIc
Name 3-(Methylthio)propanoic acid methyl ester
Alternate Name(s) Propanoic acid, 3-(methylthio)-, methyl ester Propionic acid, 3-(methylthio)-, methyl ester Methyl 3-(methylsulfanyl)propanoate 2-Methoxycarbonylethyl methyl sulfide 3-(methylthio)propionic acid methyl ester Methyl .beta.-methylmercaptopropionate Methyl .beta.-methylthiopropionate Methyl 3-(methylthio)propionate Methyl ester of 3-(methylthio)propanoic acid Methyl-3-methylmercaptopropionate AI3-36712 EINECS 236-883-6 FEMA NO. 2720 NSC 76415
CAS Registry Number 13532-18-8
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Formula C5H10O2S
InChI InChI=1S/C5H10O2S/c1-7-5(6)3-4-8-2/h3-4H2,1-2H3
InChIKey DMMJVMYCBULSIS-UHFFFAOYSA-N
Molecular Weight 134.193 g/mol
SMILES CSCCC(=O)OC
SPLASH splash10-075a-9100000000-60a8d1db6489eb853cac
Source of Spectrum W6-4607-0-0
Wiley ID 70942