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1,4-bis[(4-Chlorophenyl)(phenyl)methyl]piperazine
SpectraBase Compound ID 4BN41PZpVcs
InChI InChI=1S/C30H28Cl2N2/c31-27-15-11-25(12-16-27)29(23-7-3-1-4-8-23)33-19-21-34(22-20-33)30(24-9-5-2-6-10-24)26-13-17-28(32)18-14-26/h1-18,29-30H,19-22H2
InChIKey ZHKWYPRSELVIIG-UHFFFAOYSA-N
Mol Weight 487.47 g/mol
Molecular Formula C30H28Cl2N2
Exact Mass 486.162954 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KlU8XXdytNA
Name 1,4-bis[(4-Chlorophenyl)(phenyl)methyl]piperazine
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 486.162954310 u
Formula C30H28Cl2N2
InChI InChI=1S/C30H28Cl2N2/c31-27-15-11-25(12-16-27)29(23-7-3-1-4-8-23)33-19-21-34(22-20-33)30(24-9-5-2-6-10-24)26-13-17-28(32)18-14-26/h1-18,29-30H,19-22H2
InChIKey ZHKWYPRSELVIIG-UHFFFAOYSA-N
Molecular Weight 487.474 g/mol
SMILES C1=CC=C(C(N2CCN(C(C3=CC=C(C=C3)Cl)C3=CC=CC=C3)CC2)C2=CC=C(C=C2)Cl)C=C1