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5-Chloro-2-{[(4-chlorophenoxy)acetyl]amino}benzoic acid

View entire compound with spectra: 2 NMR

5-Chloro-2-{[(4-chlorophenoxy)acetyl]amino}benzoic acid
SpectraBase Compound ID Jxuks90Cr0O
InChI InChI=1S/C15H11Cl2NO4/c16-9-1-4-11(5-2-9)22-8-14(19)18-13-6-3-10(17)7-12(13)15(20)21/h1-7H,8H2,(H,18,19)(H,20,21)
InChIKey BSJXKZQIJXOVGQ-UHFFFAOYSA-N
Mol Weight 340.16 g/mol
Molecular Formula C15H11Cl2NO4
Exact Mass 339.006513 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DchcUa88qC7
Name 5-Chloro-2-{[(4-chlorophenoxy)acetyl]amino}benzoic acid
Comments Computed using HOSE algorithm
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Exact Mass 339.006513234 u
Formula C15H11Cl2NO4
InChI InChI=1S/C15H11Cl2NO4/c16-9-1-4-11(5-2-9)22-8-14(19)18-13-6-3-10(17)7-12(13)15(20)21/h1-7H,8H2,(H,18,19)(H,20,21)
InChIKey BSJXKZQIJXOVGQ-UHFFFAOYSA-N
Molecular Weight 340.162 g/mol
SMILES N(C=1C(C(=O)O)=CC(=CC1)Cl)C(=O)COC=1C=CC(=CC1)Cl