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N-(3-chlorophenyl)-2-{(2E)-2-[(2E)-1-methyl-3-phenyl-2-propenylidene]hydrazino}-2-oxoacetamide
SpectraBase Compound ID 2fOiquZAG83
InChI InChI=1S/C18H16ClN3O2/c1-13(10-11-14-6-3-2-4-7-14)21-22-18(24)17(23)20-16-9-5-8-15(19)12-16/h2-12H,1H3,(H,20,23)(H,22,24)/b11-10+,21-13+
InChIKey XEKWKWVYXICMMA-HGOWQPMWSA-N
Mol Weight 341.8 g/mol
Molecular Formula C18H16ClN3O2
Exact Mass 341.093104 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1bwIQFpBRFG
Name N-(3-Chlorophenyl)-2-{(2E)-2-[(2E)-1-methyl-3-phenyl-2-propenylidene]hydrazino}-2-oxoacetamide
Comments Computed using HOSE algorithm
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Exact Mass 341.093104465 u
Formula C18H16ClN3O2
InChI InChI=1S/C18H16ClN3O2/c1-13(10-11-14-6-3-2-4-7-14)21-22-18(24)17(23)20-16-9-5-8-15(19)12-16/h2-12H,1H3,(H,20,23)(H,22,24)/b11-10+,21-13+
InChIKey XEKWKWVYXICMMA-HGOWQPMWSA-N
SMILES N(C(C(N\N=C\(\C=C\C1=CC=CC=C1)C)=O)=O)C1=CC(Cl)=CC=C1