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3-[(2,6-difluorobenzoyl)amino]-3-(3-nitrophenyl)propanoic acid
SpectraBase Compound ID FbQRnKzYhdL
InChI InChI=1S/C16H12F2N2O5/c17-11-5-2-6-12(18)15(11)16(23)19-13(8-14(21)22)9-3-1-4-10(7-9)20(24)25/h1-7,13H,8H2,(H,19,23)(H,21,22)
InChIKey OYTFGGYGHNOYIO-UHFFFAOYSA-N
Mol Weight 350.28 g/mol
Molecular Formula C16H12F2N2O5
Exact Mass 350.071428 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7R8azPV3IfO
Name 3-[(2,6-difluorobenzoyl)amino]-3-(3-nitrophenyl)propanoic acid
Alternate Name(s) 3-[[(2,6-difluorophenyl)-oxomethyl]amino]-3-(3-nitrophenyl)propanoic acid 3-[[2,6-bis(fluoranyl)phenyl]carbonylamino]-3-(3-nitrophenyl)propanoic acid
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Formula C16H12F2N2O5
InChI InChI=1S/C16H12F2N2O5/c17-11-5-2-6-12(18)15(11)16(23)19-13(8-14(21)22)9-3-1-4-10(7-9)20(24)25/h1-7,13H,8H2,(H,19,23)(H,21,22)
InChIKey OYTFGGYGHNOYIO-UHFFFAOYSA-N
Molecular Weight 350.278 g/mol
SMILES N(C(c1c(F)cccc1F)=O)C(CC(=O)O)c1cc(N(=O)=O)ccc1
SPLASH splash10-0006-2910000000-9723ed1f82934e4aae18
Wiley ID 1443034