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2-Amino-4-(2-amino-5-chlorophenyl)-4-oxobutyric acid
SpectraBase Compound ID BnCHM2sCe5M
InChI InChI=1S/C10H11ClN2O3/c11-5-1-2-7(12)6(3-5)9(14)4-8(13)10(15)16/h1-3,8H,4,12-13H2,(H,15,16)
InChIKey VCCXKKFHLAJBJJ-UHFFFAOYSA-N
Mol Weight 242.66 g/mol
Molecular Formula C10H11ClN2O3
Exact Mass 242.04582 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6t9hl2Gab30
Name 2-Amino-4-(2-amino-5-chlorophenyl)-4-oxobutyric acid
Alternate Name(s) 2-Amino-4-(2-amino-5-chlorophenyl)-4-oxobutanoic acid 2-Amino-4-(2-amino-5-chloro-phenyl)-4-oxo-butanoic acid 2-Azanyl-4-(2-azanyl-5-chloranyl-phenyl)-4-oxidanylidene-butanoic acid
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Formula C10H11ClN2O3
InChI InChI=1S/C10H11ClN2O3/c11-5-1-2-7(12)6(3-5)9(14)4-8(13)10(15)16/h1-3,8H,4,12-13H2,(H,15,16)
InChIKey VCCXKKFHLAJBJJ-UHFFFAOYSA-N
Molecular Weight 242.662 g/mol
SMILES OC(C(CC(c1c(ccc(c1)Cl)N)=O)N)=O
SPLASH splash10-0ugi-0940000000-5e37bea7fc0b5b89906b
Source of Spectrum EMC-31-18-4d
Wiley ID 1734212