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4-Chloro-2-{[4-(3-chlorophenyl)-1-piperazinyl]carbonyl}phenyl methyl ether
SpectraBase Compound ID L6ssnKz4Wjs
InChI InChI=1S/C18H18Cl2N2O2/c1-24-17-6-5-14(20)12-16(17)18(23)22-9-7-21(8-10-22)15-4-2-3-13(19)11-15/h2-6,11-12H,7-10H2,1H3
InChIKey XBTHMXPSSTYETL-UHFFFAOYSA-N
Mol Weight 365.26 g/mol
Molecular Formula C18H18Cl2N2O2
Exact Mass 364.074533 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ArnBTLxNRvg
Name 4-Chloro-2-{[4-(3-chlorophenyl)-1-piperazinyl]carbonyl}phenyl methyl ether
Comments Computed using HOSE algorithm
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Exact Mass 364.074533226 u
Formula C18H18Cl2N2O2
InChI InChI=1S/C18H18Cl2N2O2/c1-24-17-6-5-14(20)12-16(17)18(23)22-9-7-21(8-10-22)15-4-2-3-13(19)11-15/h2-6,11-12H,7-10H2,1H3
InChIKey XBTHMXPSSTYETL-UHFFFAOYSA-N
Molecular Weight 365.260 g/mol
SMILES C=1(C(N2CCN(C3=CC(Cl)=CC=C3)CC2)=O)C(=CC=C(C1)Cl)OC