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3-{(E)-[2-(aminocarbonyl)hydrazono]methyl}phenyl 4-chlorobenzoate
SpectraBase Compound ID 2x8Vr9uiwVK
InChI InChI=1S/C15H12ClN3O3/c16-12-6-4-11(5-7-12)14(20)22-13-3-1-2-10(8-13)9-18-19-15(17)21/h1-9H,(H3,17,19,21)/b18-9+
InChIKey XVMZVYLMXISEAQ-GIJQJNRQSA-N
Mol Weight 317.73 g/mol
Molecular Formula C15H12ClN3O3
Exact Mass 317.056719 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EQNOBCmpo0S
Name 3-{(E)-[2-(Aminocarbonyl)hydrazono]methyl}phenyl 4-chlorobenzoate
Comments Computed using HOSE algorithm
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Exact Mass 317.056718955 u
Formula C15H12ClN3O3
InChI InChI=1S/C15H12ClN3O3/c16-12-6-4-11(5-7-12)14(20)22-13-3-1-2-10(8-13)9-18-19-15(17)21/h1-9H,(H3,17,19,21)/b18-9+
InChIKey XVMZVYLMXISEAQ-GIJQJNRQSA-N
Molecular Weight 317.732 g/mol
SMILES N(C(=O)N)\N=C\C1=CC(OC(C2=CC=C(C=C2)Cl)=O)=CC=C1