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2-(1-(4-Chlorophenyl)ethyl)-1,3-diphenylpropane-1,3-dione

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

2-(1-(4-Chlorophenyl)ethyl)-1,3-diphenylpropane-1,3-dione
SpectraBase Compound ID ncAGsBNrVD
InChI InChI=1S/C23H19ClO2/c1-16(17-12-14-20(24)15-13-17)21(22(25)18-8-4-2-5-9-18)23(26)19-10-6-3-7-11-19/h2-16,21H,1H3
InChIKey KSAKQKGFISOUNK-UHFFFAOYSA-N
Mol Weight 362.86 g/mol
Molecular Formula C23H19ClO2
Exact Mass 362.107358 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID J8CxniATJWr
Name 2-(1-(4-Chlorophenyl)ethyl)-1,3-diphenylpropane-1,3-dione
Comments Computed using HOSE algorithm
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Exact Mass 362.107357550 u
Formula C23H19ClO2
InChI InChI=1S/C23H19ClO2/c1-16(17-12-14-20(24)15-13-17)21(22(25)18-8-4-2-5-9-18)23(26)19-10-6-3-7-11-19/h2-16,21H,1H3
InChIKey KSAKQKGFISOUNK-UHFFFAOYSA-N
Molecular Weight 362.856 g/mol
SMILES C1(=CC=C(C=C1)Cl)C(C(C(=O)C1=CC=CC=C1)C(C1=CC=CC=C1)=O)C