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(5R,6S)-1-Benzyl-6-phenyl-5-(phenylsulfonyl)piperidin-2-one
SpectraBase Compound ID Bh7slzyTsRN
InChI InChI=1S/C24H23NO3S/c26-23-17-16-22(29(27,28)21-14-8-3-9-15-21)24(20-12-6-2-7-13-20)25(23)18-19-10-4-1-5-11-19/h1-15,22,24H,16-18H2/t22-,24+/m1/s1
InChIKey REHPIYKTWQCFSU-VWNXMTODSA-N
Mol Weight 405.51 g/mol
Molecular Formula C24H23NO3S
Exact Mass 405.139865 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9FKXqBpZYua
Name (5R,6S)-1-Benzyl-6-phenyl-5-(phenylsulfonyl)piperidin-2-one
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 405.139864776 u
Formula C24H23NO3S
InChI InChI=1S/C24H23NO3S/c26-23-17-16-22(29(27,28)21-14-8-3-9-15-21)24(20-12-6-2-7-13-20)25(23)18-19-10-4-1-5-11-19/h1-15,22,24H,16-18H2/t22-,24+/m1/s1
InChIKey REHPIYKTWQCFSU-VWNXMTODSA-N
Molecular Weight 405.512 g/mol
SMILES C1(N([C@]([C@@](CC1)(S(=O)(=O)C1=CC=CC=C1)[H])(C1=CC=CC=C1)[H])CC1=CC=CC=C1)=O