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N-4-Methylphenyl-N-[1-(1-phenylpropyl)piperidin-4-yl]hexanamide
SpectraBase Compound ID Ip6ZbAVHtDZ
InChI InChI=1S/C27H38N2O/c1-4-6-8-13-27(30)29(24-16-14-22(3)15-17-24)25-18-20-28(21-19-25)26(5-2)23-11-9-7-10-12-23/h7,9-12,14-17,25-26H,4-6,8,13,18-21H2,1-3H3
InChIKey TXBZQPQCDXPIEU-UHFFFAOYSA-N
Mol Weight 406.6 g/mol
Molecular Formula C27H38N2O
Exact Mass 406.298414 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID NWz2xpQkFx
Name N-4-Methylphenyl-N-[1-(1-phenylpropyl)piperidin-4-yl]hexanamide
Comments Computed using HOSE algorithm
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Exact Mass 406.298413851 u
Formula C27H38N2O
InChI InChI=1S/C27H38N2O/c1-4-6-8-13-27(30)29(24-16-14-22(3)15-17-24)25-18-20-28(21-19-25)26(5-2)23-11-9-7-10-12-23/h7,9-12,14-17,25-26H,4-6,8,13,18-21H2,1-3H3
InChIKey TXBZQPQCDXPIEU-UHFFFAOYSA-N
Molecular Weight 406.614 g/mol
SMILES C1(N(C=2C=CC(=CC2)C)C(CCCCC)=O)CCN(C(C=2C=CC=CC2)CC)CC1