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5-(2-chloro-6-fluoro-benzyl)-3,6-dimethyl-1,4-dihydropyridazine-4-carboxylic acid ethyl ester
SpectraBase Compound ID 6nGqw3WDhQ3
InChI InChI=1S/C16H18ClFN2O2/c1-4-22-16(21)15-10(3)20-19-9(2)11(15)8-12-13(17)6-5-7-14(12)18/h5-7,15,19H,4,8H2,1-3H3
InChIKey IDKXLIKLKPKWHC-UHFFFAOYSA-N
Mol Weight 324.78 g/mol
Molecular Formula C16H18ClFN2O2
Exact Mass 324.104084 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 79mRBR7bI1v
Name 5-(2-chloro-6-fluoro-benzyl)-3,6-dimethyl-1,4-dihydropyridazine-4-carboxylic acid ethyl ester
Compound Number 5T
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Formula C16H18ClFN2O2
InChI InChI=1S/C16H18ClFN2O2/c1-4-22-16(21)15-10(3)20-19-9(2)11(15)8-12-13(17)6-5-7-14(12)18/h5-7,15,19H,4,8H2,1-3H3
InChIKey IDKXLIKLKPKWHC-UHFFFAOYSA-N
Literature Reference Author O.A.ATTANASI,P.FILIPPONE,C.FIORUCCI,E.FORESTI,F.MANTELLINI
Literature Reference Citation J.ORG.CHEM.,63,9880(1998)
Literature Reference DOI 10.1021/jo9816515
Molecular Weight 324.783 g/mol
Sample ID 27009
Solvent CDCl3