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3-(3-nitrophenyl)-3-(2-phenoxyethanoylamino)propanoic acid
SpectraBase Compound ID 1lKmDDz0CmP
InChI InChI=1S/C17H16N2O6/c20-16(11-25-14-7-2-1-3-8-14)18-15(10-17(21)22)12-5-4-6-13(9-12)19(23)24/h1-9,15H,10-11H2,(H,18,20)(H,21,22)
InChIKey JGHQYBLASGWIQP-UHFFFAOYSA-N
Mol Weight 344.32 g/mol
Molecular Formula C17H16N2O6
Exact Mass 344.100836 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GZMpXOl0Qit
Name 3-(3-nitrophenyl)-3-(2-phenoxyethanoylamino)propanoic acid
Alternate Name(s) 3-(3-nitrophenyl)-3-[(1-oxo-2-phenoxyethyl)amino]propanoic acid 3-(3-nitrophenyl)-3-[(2-phenoxyacetyl)amino]propanoic acid
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Formula C17H16N2O6
InChI InChI=1S/C17H16N2O6/c20-16(11-25-14-7-2-1-3-8-14)18-15(10-17(21)22)12-5-4-6-13(9-12)19(23)24/h1-9,15H,10-11H2,(H,18,20)(H,21,22)
InChIKey JGHQYBLASGWIQP-UHFFFAOYSA-N
Molecular Weight 344.323 g/mol
SMILES N(C(CC(=O)O)c1cc(N(=O)=O)ccc1)C(=O)COc1ccccc1
SPLASH splash10-056r-9600000000-d67f92445ea7aada42bb
Wiley ID 1445797