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1-[2-(2,4-Dichlorophenoxy)propanoyl]-4-(2,3-dimethylphenyl)piperazine

View entire compound with spectra: 2 NMR

1-[2-(2,4-Dichlorophenoxy)propanoyl]-4-(2,3-dimethylphenyl)piperazine
SpectraBase Compound ID ETl4SSNN6qn
InChI InChI=1S/C21H24Cl2N2O2/c1-14-5-4-6-19(15(14)2)24-9-11-25(12-10-24)21(26)16(3)27-20-8-7-17(22)13-18(20)23/h4-8,13,16H,9-12H2,1-3H3
InChIKey CLKHIQFJSIIVNQ-UHFFFAOYSA-N
Mol Weight 407.34 g/mol
Molecular Formula C21H24Cl2N2O2
Exact Mass 406.121483 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CUfQQL8JV1
Name 1-[2-(2,4-Dichlorophenoxy)propanoyl]-4-(2,3-dimethylphenyl)piperazine
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 406.121483419 u
Formula C21H24Cl2N2O2
InChI InChI=1S/C21H24Cl2N2O2/c1-14-5-4-6-19(15(14)2)24-9-11-25(12-10-24)21(26)16(3)27-20-8-7-17(22)13-18(20)23/h4-8,13,16H,9-12H2,1-3H3
InChIKey CLKHIQFJSIIVNQ-UHFFFAOYSA-N
Molecular Weight 407.341 g/mol
SMILES C(N1CCN(CC1)C1=C(C(C)=CC=C1)C)(C(OC=1C(=CC(=CC1)Cl)Cl)C)=O