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2-[1-[[(2R)-2-acetamido-3-keto-3-methoxy-propyl]thio]-1-methyl-ethyl]malonic acid diethyl ester
SpectraBase Compound ID EoXg4v7KbSI
InChI InChI=1S/C16H27NO7S/c1-7-23-14(20)12(15(21)24-8-2)16(4,5)25-9-11(13(19)22-6)17-10(3)18/h11-12H,7-9H2,1-6H3,(H,17,18)/t11-/m0/s1
InChIKey KTFLQBJWEMFHER-NSHDSACASA-N
Mol Weight 377.45 g/mol
Molecular Formula C16H27NO7S
Exact Mass 377.150823 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IN7fs6Qvavu
Name 2-[1-[[(2R)-2-acetamido-3-keto-3-methoxy-propyl]thio]-1-methyl-ethyl]malonic acid diethyl ester
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Formula C16H27NO7S
InChI InChI=1S/C16H27NO7S/c1-7-23-14(20)12(15(21)24-8-2)16(4,5)25-9-11(13(19)22-6)17-10(3)18/h11-12H,7-9H2,1-6H3,(H,17,18)/t11-/m0/s1
InChIKey KTFLQBJWEMFHER-NSHDSACASA-N
Molecular Weight 377.452 g/mol
SMILES N([C@@](CSC(C(C(=O)OCC)C(=O)OCC)(C)C)(C(=O)OC)[H])C(=O)C
SPLASH splash10-00or-2968000000-6266fd5351591578d3a4
Source of Spectrum F-70-1990-7
Synonyms 2-[2-[[(2R)-2-acetamido-3-methoxy-3-oxopropyl]thio]propan-2-yl]propanedioic acid diethyl ester Diethyl 2-[1-[(2R)-2-acetamido-3-methoxy-3-oxo-propyl]sulfanyl-1-methyl-ethyl]propanedioate Diethyl 2-[2-[(2R)-2-acetamido-3-methoxy-3-oxidanylidene-propyl]sulfanylpropan-2-yl]propanedioate Diethyl 2-[2-[(2R)-2-acetamido-3-methoxy-3-oxopropyl]sulfanylpropan-2-yl]propanedioate
Wiley ID 1596478