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3-Amino-3-(4-methylsulfanyl-phenyl)-propionic acid
SpectraBase Compound ID IXdVQfU3XeC
InChI InChI=1S/C10H13NO2S/c1-14-8-4-2-7(3-5-8)9(11)6-10(12)13/h2-5,9H,6,11H2,1H3,(H,12,13)
InChIKey ZJVWWXSYESPZPZ-UHFFFAOYSA-N
Mol Weight 211.28 g/mol
Molecular Formula C10H13NO2S
Exact Mass 211.0667 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 47F08DP4tu6
Name 3-Amino-3-(4-methylsulfanyl-phenyl)-propionic acid
Alternate Name(s) 3-Amino-3-(4-methylsulfanylphenyl)propanoic acid 3-Amino-3-[4-(methylthio)phenyl]propanoic acid 3-Amino-3-[4-(methylthio)phenyl]propionic acid 3-Azanyl-3-(4-methylsulfanylphenyl)propanoic acid 3-[4-(Methylsulfanyl)phenyl]-.beta.-alanine
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Formula C10H13NO2S
InChI InChI=1S/C10H13NO2S/c1-14-8-4-2-7(3-5-8)9(11)6-10(12)13/h2-5,9H,6,11H2,1H3,(H,12,13)
InChIKey ZJVWWXSYESPZPZ-UHFFFAOYSA-N
Molecular Weight 211.279 g/mol
SMILES OC(CC(c1ccc(SC)cc1)N)=O
SPLASH splash10-0udi-7900000000-a6730c75edde986f2244
Wiley ID 1464802