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(2R)-Ethyl 2-[2-{(Ethoxycarbonyl)(methylsulfanyl)methyl}phenylamino]propionate
SpectraBase Compound ID 5PaEhtQR7cl
InChI InChI=1S/C16H23NO4S/c1-5-20-15(18)11(3)17-13-10-8-7-9-12(13)14(22-4)16(19)21-6-2/h7-11,14,17H,5-6H2,1-4H3/t11-,14?/m1/s1
InChIKey LPUOCLNMVHYEIV-YNODCEANSA-N
Mol Weight 325.42 g/mol
Molecular Formula C16H23NO4S
Exact Mass 325.134779 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CDi5oswAqib
Name (2R)-Ethyl 2-[2-{(Ethoxycarbonyl)(methylsulfanyl)methyl}phenylamino]propionate
Alternate Name(s) Ethyl 2-[2-(Ethoxycarbonylmethylsulfanylmethyl)phenylamino]propionate (2R)-ethyl 2-((2-(2-ethoxy-1-(methylthio)-2-oxoethyl)phenyl)amino)propanoate
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Formula C16H23NO4S
InChI InChI=1S/C16H23NO4S/c1-5-20-15(18)11(3)17-13-10-8-7-9-12(13)14(22-4)16(19)21-6-2/h7-11,14,17H,5-6H2,1-4H3/t11-,14?/m1/s1
InChIKey LPUOCLNMVHYEIV-YNODCEANSA-N
Molecular Weight 325.423 g/mol
SMILES N(c1c(C(C(=O)OCC)SC)cccc1)[C@@](C(=O)OCC)(C)[H]
SPLASH splash10-004i-2690000000-628b57734bd63297caee
Source of Spectrum HC-46-1213-3
Wiley ID 1733938