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N-(1-Benzylpiperidin-4-yl)-N-(4-fluorophenyl)-2-methyl-propanamide
SpectraBase Compound ID FAdlZ1wlBxg
InChI InChI=1S/C22H27FN2O/c1-17(2)22(26)25(20-10-8-19(23)9-11-20)21-12-14-24(15-13-21)16-18-6-4-3-5-7-18/h3-11,17,21H,12-16H2,1-2H3
InChIKey XNQGKYHSTDKIKG-UHFFFAOYSA-N
Mol Weight 354.47 g/mol
Molecular Formula C22H27FN2O
Exact Mass 354.210742 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FJ1VI3T9Q7O
Name N-(1-Benzylpiperidin-4-yl)-N-(4-fluorophenyl)-2-methyl-propanamide
Comments Computed using HOSE algorithm
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Exact Mass 354.210741659 u
Formula C22H27FN2O
InChI InChI=1S/C22H27FN2O/c1-17(2)22(26)25(20-10-8-19(23)9-11-20)21-12-14-24(15-13-21)16-18-6-4-3-5-7-18/h3-11,17,21H,12-16H2,1-2H3
InChIKey XNQGKYHSTDKIKG-UHFFFAOYSA-N
Molecular Weight 354.469 g/mol
SMILES C1(N(C=2C=CC(=CC2)F)C(C(C)C)=O)CCN(CC2=CC=CC=C2)CC1