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1-Benzhydryl-4-(3,4-dichlorobenzoyl)piperazine
SpectraBase Compound ID 706TmssHLVw
InChI InChI=1S/C24H22Cl2N2O/c25-21-12-11-20(17-22(21)26)24(29)28-15-13-27(14-16-28)23(18-7-3-1-4-8-18)19-9-5-2-6-10-19/h1-12,17,23H,13-16H2
InChIKey IQHILWKENYEQEE-UHFFFAOYSA-N
Mol Weight 425.36 g/mol
Molecular Formula C24H22Cl2N2O
Exact Mass 424.110919 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8fHWrQhrax2
Name 1-Benzhydryl-4-(3,4-dichlorobenzoyl)piperazine
Comments Computed using HOSE algorithm
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Exact Mass 424.110918735 u
Formula C24H22Cl2N2O
InChI InChI=1S/C24H22Cl2N2O/c25-21-12-11-20(17-22(21)26)24(29)28-15-13-27(14-16-28)23(18-7-3-1-4-8-18)19-9-5-2-6-10-19/h1-12,17,23H,13-16H2
InChIKey IQHILWKENYEQEE-UHFFFAOYSA-N
Molecular Weight 425.359 g/mol
SMILES C(N1CCN(CC1)C(C=1C=CC=CC1)C=1C=CC=CC1)(C1=CC(Cl)=C(C=C1)Cl)=O