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2-(2-Benzyloxyphenylamino)-5-nitrobenzoic acid
SpectraBase Compound ID L9zYD3CHFkj
InChI InChI=1S/C20H16N2O5/c23-20(24)16-12-15(22(25)26)10-11-17(16)21-18-8-4-5-9-19(18)27-13-14-6-2-1-3-7-14/h1-12,21H,13H2,(H,23,24)
InChIKey XJWIVDWDNDBHIQ-UHFFFAOYSA-N
Mol Weight 364.36 g/mol
Molecular Formula C20H16N2O5
Exact Mass 364.105922 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HQiFGMmGbqI
Name 2-(2-Benzyloxyphenylamino)-5-nitrobenzoic acid
Comments Computed using HOSE algorithm
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Exact Mass 364.105921618 u
Formula C20H16N2O5
InChI InChI=1S/C20H16N2O5/c23-20(24)16-12-15(22(25)26)10-11-17(16)21-18-8-4-5-9-19(18)27-13-14-6-2-1-3-7-14/h1-12,21H,13H2,(H,23,24)
InChIKey XJWIVDWDNDBHIQ-UHFFFAOYSA-N
Molecular Weight 364.357 g/mol
SMILES C1(N(=O)=O)=CC=C(C(=C1)C(O)=O)NC=1C(OCC2=CC=CC=C2)=CC=CC1