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[[2-keto-2-[[(1S)-1-phenylethyl]amino]ethyl]thio]methanethioic acid O-ethyl ester
SpectraBase Compound ID cVZML0CxXt
InChI InChI=1S/C13H17NO2S2/c1-3-16-13(17)18-9-12(15)14-10(2)11-7-5-4-6-8-11/h4-8,10H,3,9H2,1-2H3,(H,14,15)/t10-/m0/s1
InChIKey RDLKHDICBFBQCW-JTQLQIEISA-N
Mol Weight 283.4 g/mol
Molecular Formula C13H17NO2S2
Exact Mass 283.070071 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GbwgnpzBHPs
Name [[2-keto-2-[[(1S)-1-phenylethyl]amino]ethyl]thio]methanethioic acid O-ethyl ester
Alternate Name(s) [[2-oxo-2-[[(1S)-1-phenylethyl]amino]ethyl]thio]methanethioic acid O-ethyl ester O-ethyl [2-oxo-2-[[(1S)-1-phenylethyl]amino]ethyl]sulfanylmethanethioate
Comments Less than 3 mono-isotopic peaks
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Formula C13H17NO2S2
InChI InChI=1S/C13H17NO2S2/c1-3-16-13(17)18-9-12(15)14-10(2)11-7-5-4-6-8-11/h4-8,10H,3,9H2,1-2H3,(H,14,15)/t10-/m0/s1
InChIKey RDLKHDICBFBQCW-JTQLQIEISA-N
Molecular Weight 283.404 g/mol
SMILES N(C(CSC(=S)OCC)=O)[C@](c1ccccc1)(C)[H]
SPLASH splash10-03di-0920000000-2e7e373a7dd319b32211
Source of Spectrum Y1-46-7693-10
Wiley ID 1622713