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3-[(4-chloranyl-3-nitro-phenyl)carbonylamino]-3-(4-chlorophenyl)propanoic acid
SpectraBase Compound ID E22IgdrHeFT
InChI InChI=1S/C16H12Cl2N2O5/c17-11-4-1-9(2-5-11)13(8-15(21)22)19-16(23)10-3-6-12(18)14(7-10)20(24)25/h1-7,13H,8H2,(H,19,23)(H,21,22)
InChIKey WICWWQJORHNLFZ-UHFFFAOYSA-N
Mol Weight 383.19 g/mol
Molecular Formula C16H12Cl2N2O5
Exact Mass 382.012327 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C1rWCzrb0Ed
Name 3-[(4-chloranyl-3-nitro-phenyl)carbonylamino]-3-(4-chlorophenyl)propanoic acid
Alternate Name(s) 3-[(4-chloro-3-nitro-benzoyl)amino]-3-(4-chlorophenyl)propanoic acid 3-[[(4-chloro-3-nitrophenyl)-oxomethyl]amino]-3-(4-chlorophenyl)propanoic acid 3-[(4-chloro-3-nitrobenzoyl)amino]-3-(4-chlorophenyl)propanoic acid
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Formula C16H12Cl2N2O5
InChI InChI=1S/C16H12Cl2N2O5/c17-11-4-1-9(2-5-11)13(8-15(21)22)19-16(23)10-3-6-12(18)14(7-10)20(24)25/h1-7,13H,8H2,(H,19,23)(H,21,22)
InChIKey WICWWQJORHNLFZ-UHFFFAOYSA-N
Molecular Weight 383.187 g/mol
SMILES OC(CC(c1ccc(cc1)Cl)NC(=O)c1cc(c(cc1)Cl)N(=O)=O)=O
SPLASH splash10-01s5-4900000000-840803ec5dee0b98e003
Wiley ID 1445780