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3-{(E)-[2-(4-chlorobenzoyl)hydrazono]methyl}phenyl 4-methoxybenzoate
SpectraBase Compound ID IDf4nPJAzhP
InChI InChI=1S/C22H17ClN2O4/c1-28-19-11-7-17(8-12-19)22(27)29-20-4-2-3-15(13-20)14-24-25-21(26)16-5-9-18(23)10-6-16/h2-14H,1H3,(H,25,26)/b24-14+
InChIKey DUSBRUYXQKVZRA-ZVHZXABRSA-N
Mol Weight 408.84 g/mol
Molecular Formula C22H17ClN2O4
Exact Mass 408.087685 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LG5IUyyX9IQ
Name 3-{(E)-[2-(4-Chlorobenzoyl)hydrazono]methyl}phenyl 4-methoxybenzoate
Comments Computed using HOSE algorithm
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Exact Mass 408.087684731 u
Formula C22H17ClN2O4
InChI InChI=1S/C22H17ClN2O4/c1-28-19-11-7-17(8-12-19)22(27)29-20-4-2-3-15(13-20)14-24-25-21(26)16-5-9-18(23)10-6-16/h2-14H,1H3,(H,25,26)/b24-14+
InChIKey DUSBRUYXQKVZRA-ZVHZXABRSA-N
Molecular Weight 408.841 g/mol
SMILES N(C(C1=CC=C(C=C1)Cl)=O)\N=C\C=1C=C(OC(C2=CC=C(C=C2)OC)=O)C=CC1