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(2S,3R)-3-(4-Chlorophenyl)glutamic acid
SpectraBase Compound ID 338d5zQPsz7
InChI InChI=1S/C11H12ClNO4/c12-7-3-1-6(2-4-7)8(5-9(14)15)10(13)11(16)17/h1-4,8,10H,5,13H2,(H,14,15)(H,16,17)/t8-,10+/m1/s1
InChIKey ZHXBCPSYEAQEHB-SCZZXKLOSA-N
Mol Weight 257.67 g/mol
Molecular Formula C11H12ClNO4
Exact Mass 257.045486 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 32EEwJeWQ4
Name (2S,3R)-3-(4-Chlorophenyl)glutamic acid
Alternate Name(s) (2S,3R)-2-amino-3-(4-chlorophenyl)pentanedioic acid (2S,3R)-2-azanyl-3-(4-chlorophenyl)pentanedioic acid
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Formula C11H12ClNO4
InChI InChI=1S/C11H12ClNO4/c12-7-3-1-6(2-4-7)8(5-9(14)15)10(13)11(16)17/h1-4,8,10H,5,13H2,(H,14,15)(H,16,17)/t8-,10+/m1/s1
InChIKey ZHXBCPSYEAQEHB-SCZZXKLOSA-N
Molecular Weight 257.673 g/mol
SMILES OC([C@]([C@](CC(=O)O)(c1ccc(cc1)Cl)[H])(N)[H])=O
SPLASH splash10-0frl-0910000000-dd9cec86ad2701f8baa0
Source of Spectrum F-59-227-16f
Wiley ID 1676666