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2-Ethyl-N-(3-methylphenyl)-N-(1-(2-phenylethyl)piperidin-4-yl)butanamide
SpectraBase Compound ID KJhK7VctcDQ
InChI InChI=1S/C26H36N2O/c1-4-23(5-2)26(29)28(25-13-9-10-21(3)20-25)24-15-18-27(19-16-24)17-14-22-11-7-6-8-12-22/h6-13,20,23-24H,4-5,14-19H2,1-3H3
InChIKey NKVHYEFEVNQRSU-UHFFFAOYSA-N
Mol Weight 392.6 g/mol
Molecular Formula C26H36N2O
Exact Mass 392.282764 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KMcwhZQwAAQ
Name 2-Ethyl-N-(3-methylphenyl)-N-(1-(2-phenylethyl)piperidin-4-yl)butanamide
Comments Computed using HOSE algorithm
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Exact Mass 392.282763786 u
Formula C26H36N2O
InChI InChI=1S/C26H36N2O/c1-4-23(5-2)26(29)28(25-13-9-10-21(3)20-25)24-15-18-27(19-16-24)17-14-22-11-7-6-8-12-22/h6-13,20,23-24H,4-5,14-19H2,1-3H3
InChIKey NKVHYEFEVNQRSU-UHFFFAOYSA-N
Molecular Weight 392.587 g/mol
SMILES C1(N(C=2C=C(C=CC2)C)C(C(CC)CC)=O)CCN(CC1)CCC=1C=CC=CC1