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(2S)-2-[(2-chloro-1-oxoethyl)amino]-3-hydroxypropanoic acid methyl ester
SpectraBase Compound ID 2sqFWCPjf9e
InChI InChI=1S/C6H10ClNO4/c1-12-6(11)4(3-9)8-5(10)2-7/h4,9H,2-3H2,1H3,(H,8,10)/t4-/m0/s1
InChIKey SDIQFJSMWGNNKI-BYPYZUCNSA-N
Mol Weight 195.6 g/mol
Molecular Formula C6H10ClNO4
Exact Mass 195.029836 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1ehGGVM2iRX
Name (2S)-2-[(2-chloro-1-oxoethyl)amino]-3-hydroxypropanoic acid methyl ester
Alternate Name(s) (2S)-2-[(2-chloroacetyl)amino]-3-hydroxy-propionic acid methyl ester Methyl (2S)-2-(2-chloranylethanoylamino)-3-oxidanyl-propanoate Methyl (2S)-2-[(2-chloroacetyl)amino]-3-hydroxy-propanoate
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Formula C6H10ClNO4
InChI InChI=1S/C6H10ClNO4/c1-12-6(11)4(3-9)8-5(10)2-7/h4,9H,2-3H2,1H3,(H,8,10)/t4-/m0/s1
InChIKey SDIQFJSMWGNNKI-BYPYZUCNSA-N
Molecular Weight 195.602 g/mol
SMILES N([C@@](CO)(C(=O)OC)[H])C(=O)CCl
SPLASH splash10-00kr-2900000000-6054566040d82d405368
Source of Spectrum KD-12-1296-8
Wiley ID 1634453