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Dimethyl (S,S)-.alpha.,.alpha'.-diamino-2,3-thiophenedipropionate
SpectraBase Compound ID HgXvDgaTe6h
InChI InChI=1S/C12H18N2O4S/c1-17-11(15)8(13)5-7-3-4-19-10(7)6-9(14)12(16)18-2/h3-4,8-9H,5-6,13-14H2,1-2H3/t8-,9-/m0/s1
InChIKey XSYRZFHQDSCOHY-IUCAKERBSA-N
Mol Weight 286.35 g/mol
Molecular Formula C12H18N2O4S
Exact Mass 286.098728 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1e8JwyEvpfd
Name Dimethyl (S,S)-.alpha.,.alpha'.-diamino-2,3-thiophenedipropionate
Alternate Name(s) Methyl (2S)-2-amino-3-{2-[(2S)-2-amino-3-methoxy-3-oxopropyl]-3-thienyl}propanoate
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Formula C12H18N2O4S
InChI InChI=1S/C12H18N2O4S/c1-17-11(15)8(13)5-7-3-4-19-10(7)6-9(14)12(16)18-2/h3-4,8-9H,5-6,13-14H2,1-2H3/t8-,9-/m0/s1
InChIKey XSYRZFHQDSCOHY-IUCAKERBSA-N
Molecular Weight 286.346 g/mol
SMILES N[C@@](Cc1c(C[C@@](C(=O)OC)(N)[H])scc1)(C(=O)OC)[H]
SPLASH splash10-03dr-6900000000-b337e8872da4f0d2e79c
Source of Spectrum SB-51-399-16
Wiley ID 1289389