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(2S,3R)-2-methyl-3-(tosylamino)valeric acid ethyl ester
SpectraBase Compound ID CglnEN904da
InChI InChI=1S/C15H23NO4S/c1-5-14(12(4)15(17)20-6-2)16-21(18,19)13-9-7-11(3)8-10-13/h7-10,12,14,16H,5-6H2,1-4H3/t12-,14+/m0/s1
InChIKey MTEIXIHVFVLQCF-GXTWGEPZSA-N
Mol Weight 313.41 g/mol
Molecular Formula C15H23NO4S
Exact Mass 313.134779 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID rIVygv1ai
Name (2S,3R)-2-methyl-3-(tosylamino)valeric acid ethyl ester
Alternate Name(s) (2S,3R)-2-methyl-3-[(4-methylphenyl)sulfonylamino]pentanoic acid ethyl ester Ethyl (2S,3R)-2-methyl-3-(p-tolylsulfonylamino)pentanoate
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Formula C15H23NO4S
InChI InChI=1S/C15H23NO4S/c1-5-14(12(4)15(17)20-6-2)16-21(18,19)13-9-7-11(3)8-10-13/h7-10,12,14,16H,5-6H2,1-4H3/t12-,14+/m0/s1
InChIKey MTEIXIHVFVLQCF-GXTWGEPZSA-N
Molecular Weight 313.412 g/mol
SMILES N(S(c1ccc(cc1)C)(=O)=O)[C@@]([C@@](C(=O)OCC)(C)[H])(CC)[H]
SPLASH splash10-06r6-8590000000-fe140539a8297b99220f
Source of Spectrum H-77-2145-12
Wiley ID 1314127