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1-[3,4-Dichlorophenyl]-4-[2-quinolyl]-1,3-butanedione

View entire compound with spectra: 1 NMR

1-[3,4-Dichlorophenyl]-4-[2-quinolyl]-1,3-butanedione
SpectraBase Compound ID Icn3M9FaZ5I
InChI InChI=1S/C19H13Cl2NO2/c20-16-8-6-13(9-17(16)21)19(24)11-15(23)10-14-7-5-12-3-1-2-4-18(12)22-14/h1-9H,10-11H2
InChIKey UBTQIRBRWDKAJS-UHFFFAOYSA-N
Mol Weight 358.22 g/mol
Molecular Formula C19H13Cl2NO2
Exact Mass 357.032334 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FAA0gHZPqvC
Name 1-[3,4-Dichlorophenyl]-4-[2-quinolyl]-1,3-butanedione
Comments Computed using HOSE algorithm
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Exact Mass 357.032334061 u
Formula C19H13Cl2NO2
InChI InChI=1S/C19H13Cl2NO2/c20-16-8-6-13(9-17(16)21)19(24)11-15(23)10-14-7-5-12-3-1-2-4-18(12)22-14/h1-9H,10-11H2
InChIKey UBTQIRBRWDKAJS-UHFFFAOYSA-N
Molecular Weight 358.224 g/mol
SMILES C1(Cl)=CC=C(C=C1Cl)C(=O)CC(=O)CC1=NC2=C(C=CC=C2)C=C1