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N-[4-(4-benzyl-1-piperazinyl)phenyl]hexanamide
SpectraBase Compound ID AWf2dgvkMds
InChI InChI=1S/C23H31N3O/c1-2-3-5-10-23(27)24-21-11-13-22(14-12-21)26-17-15-25(16-18-26)19-20-8-6-4-7-9-20/h4,6-9,11-14H,2-3,5,10,15-19H2,1H3,(H,24,27)
InChIKey JIWBDIUIGRCRHP-UHFFFAOYSA-N
Mol Weight 365.52 g/mol
Molecular Formula C23H31N3O
Exact Mass 365.246713 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LxvIsxHxm2v
Name N-[4-(4-Benzyl-1-piperazinyl)phenyl]hexanamide
Comments Computed using HOSE algorithm
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Exact Mass 365.246712629 u
Formula C23H31N3O
InChI InChI=1S/C23H31N3O/c1-2-3-5-10-23(27)24-21-11-13-22(14-12-21)26-17-15-25(16-18-26)19-20-8-6-4-7-9-20/h4,6-9,11-14H,2-3,5,10,15-19H2,1H3,(H,24,27)
InChIKey JIWBDIUIGRCRHP-UHFFFAOYSA-N
Molecular Weight 365.521 g/mol
SMILES N(C(=O)CCCCC)C1=CC=C(N2CCN(CC2)CC=2C=CC=CC2)C=C1