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(2R,3R)-3-(Benzyloxy)-2[(1S,2R)-3-(hydroxy)-1,2-(isopropylidenedioxy)propyl]piperidin-6-one

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(2R,3R)-3-(Benzyloxy)-2[(1S,2R)-3-(hydroxy)-1,2-(isopropylidenedioxy)propyl]piperidin-6-one
SpectraBase Compound ID ES6TuuXaWtN
InChI InChI=1S/C18H27NO4/c1-18(2)22-15(11-20)17(23-18)16-14(9-6-10-19-16)21-12-13-7-4-3-5-8-13/h3-5,7-8,14-17,19-20H,6,9-12H2,1-2H3/t14-,15-,16-,17-/m1/s1
InChIKey IGGPBWHGMJRTRR-QBPKDAKJSA-N
Mol Weight 321.42 g/mol
Molecular Formula C18H27NO4
Exact Mass 321.194008 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5kIjcLZ89RA
Name (2R,3R)-3-(Benzyloxy)-2[(1S,2R)-3-(hydroxy)-1,2-(isopropylidenedioxy)propyl]piperidin-6-one
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 321.194008349 u
Formula C18H27NO4
InChI InChI=1S/C18H27NO4/c1-18(2)22-15(11-20)17(23-18)16-14(9-6-10-19-16)21-12-13-7-4-3-5-8-13/h3-5,7-8,14-17,19-20H,6,9-12H2,1-2H3/t14-,15-,16-,17-/m1/s1
InChIKey IGGPBWHGMJRTRR-QBPKDAKJSA-N
Molecular Weight 321.417 g/mol
SMILES [C@]1([C@@]2(NCCC[C@]2(OCC2=CC=CC=C2)[H])[H])(OC(C)(C)O[C@@]1(CO)[H])[H]