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[3R,1'S,2'S] / [3R,1'S,2'R}-N-(2'-Hydroxy-1'-methyl-2'-phenylethyl)-3-hydroxy-m-methyl-3-phenylpropanamide
SpectraBase Compound ID FfmMtHSLsCY
InChI InChI=1S/C19H23NO3/c1-14(19(23)16-11-7-4-8-12-16)20(2)18(22)13-17(21)15-9-5-3-6-10-15/h3-12,14,17,19,21,23H,13H2,1-2H3/t14-,17?,19+/m0/s1
InChIKey MBWMDIPULNPSSB-AHMQINRISA-N
Mol Weight 313.4 g/mol
Molecular Formula C19H23NO3
Exact Mass 313.167794 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CL1eOXNCRwj
Name [3R,1'S,2'S] / [3R,1'S,2'R}-N-(2'-Hydroxy-1'-methyl-2'-phenylethyl)-3-hydroxy-m-methyl-3-phenylpropanamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 313.167793602 u
Formula C19H23NO3
InChI InChI=1S/C19H23NO3/c1-14(19(23)16-11-7-4-8-12-16)20(2)18(22)13-17(21)15-9-5-3-6-10-15/h3-12,14,17,19,21,23H,13H2,1-2H3/t14-,17?,19+/m0/s1
InChIKey MBWMDIPULNPSSB-AHMQINRISA-N
Molecular Weight 313.397 g/mol
SMILES C(N([C@]([C@](C1=CC=CC=C1)(O)[H])(C)[H])C)(CC(C1=CC=CC=C1)O)=O