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Dimethyl (S,S)-.alpha.,.alpha'.-diamino-5-methyl-2,3-thiophenedipropionate
SpectraBase Compound ID 3jiQHbBTVTM
InChI InChI=1S/C13H20N2O4S/c1-7-4-8(5-9(14)12(16)18-2)11(20-7)6-10(15)13(17)19-3/h4,9-10H,5-6,14-15H2,1-3H3/t9-,10-/m0/s1
InChIKey LUPVIVFOFQYHSK-UWVGGRQHSA-N
Mol Weight 300.37 g/mol
Molecular Formula C13H20N2O4S
Exact Mass 300.114378 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 36YqufM5oxx
Name Dimethyl (S,S)-.alpha.,.alpha'.-diamino-5-methyl-2,3-thiophenedipropionate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H20N2O4S
InChI InChI=1S/C13H20N2O4S/c1-7-4-8(5-9(14)12(16)18-2)11(20-7)6-10(15)13(17)19-3/h4,9-10H,5-6,14-15H2,1-3H3/t9-,10-/m0/s1
InChIKey LUPVIVFOFQYHSK-UWVGGRQHSA-N
Molecular Weight 300.373 g/mol
SMILES N[C@@](Cc1c(C[C@@](C(=O)OC)(N)[H])sc(c1)C)(C(=O)OC)[H]
SPLASH splash10-0udi-1379000000-13c823fdc0127fba576a
Source of Spectrum SB-51-400-16
Synonyms Methyl (2S)-2-amino-3-{2-[(2S)-2-amino-3-methoxy-3-oxopropyl]-5-methyl-3-thienyl}propanoate
Wiley ID 1302468