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(2S)-2-[(6-ketocyclohexen-1-yl)amino]propionic acid ethyl ester
SpectraBase Compound ID 2tSngZwbNeM
InChI InChI=1S/C11H17NO3/c1-3-15-11(14)8(2)12-9-6-4-5-7-10(9)13/h6,8,12H,3-5,7H2,1-2H3/t8-/m0/s1
InChIKey MNJKZZUXHYPWKS-QMMMGPOBSA-N
Mol Weight 211.26 g/mol
Molecular Formula C11H17NO3
Exact Mass 211.120843 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5sBMhFmorWZ
Name (2S)-2-[(6-ketocyclohexen-1-yl)amino]propionic acid ethyl ester
Alternate Name(s) (2S)-2-[(6-oxo-1-cyclohexenyl)amino]propanoic acid ethyl ester Ethyl (2S)-2-[(6-oxidanylidenecyclohexen-1-yl)amino]propanoate Ethyl (2S)-2-[(6-oxocyclohexen-1-yl)amino]propanoate
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Formula C11H17NO3
InChI InChI=1S/C11H17NO3/c1-3-15-11(14)8(2)12-9-6-4-5-7-10(9)13/h6,8,12H,3-5,7H2,1-2H3/t8-/m0/s1
InChIKey MNJKZZUXHYPWKS-QMMMGPOBSA-N
Molecular Weight 211.261 g/mol
SMILES N(C=1C(=O)CCCC1)[C@](C(=O)OCC)(C)[H]
SPLASH splash10-000i-1910000000-f7c630fa414f1225b562
Source of Spectrum Y-34-35-10
Wiley ID 1210395