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1-[4-(2,4-Dichlorophenoxy)butanoyl]-4-phenylpiperazine

View entire compound with spectra: 2 NMR

1-[4-(2,4-Dichlorophenoxy)butanoyl]-4-phenylpiperazine
SpectraBase Compound ID H3NeZ2jFLBN
InChI InChI=1S/C20H22Cl2N2O2/c21-16-8-9-19(18(22)15-16)26-14-4-7-20(25)24-12-10-23(11-13-24)17-5-2-1-3-6-17/h1-3,5-6,8-9,15H,4,7,10-14H2
InChIKey IVQSWGRXIWBWGA-UHFFFAOYSA-N
Mol Weight 393.31 g/mol
Molecular Formula C20H22Cl2N2O2
Exact Mass 392.105833 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FPCnwszAEMY
Name 1-[4-(2,4-Dichlorophenoxy)butanoyl]-4-phenylpiperazine
Comments Computed using HOSE algorithm
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Exact Mass 392.105833354 u
Formula C20H22Cl2N2O2
InChI InChI=1S/C20H22Cl2N2O2/c21-16-8-9-19(18(22)15-16)26-14-4-7-20(25)24-12-10-23(11-13-24)17-5-2-1-3-6-17/h1-3,5-6,8-9,15H,4,7,10-14H2
InChIKey IVQSWGRXIWBWGA-UHFFFAOYSA-N
Molecular Weight 393.314 g/mol
SMILES C=1C=CC(N2CCN(C(=O)CCCOC3=C(C=C(C=C3)Cl)Cl)CC2)=CC1