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#34;5-(4-FLUOROPHENYL)-1-[2-[(2R,4R)-4-HYDROXY-6-OXOTETRAHYDRO-2H-PYRAN-2-YL]-ETHYL]-N-[4-[3-[2-[2-(2-HYDROXYETHOXY)-ETHOXY]-ETHOXY]-PROPYL]-PHENYL]-2-ISOPROPY
SpectraBase Compound ID BVbqW7oKr6M
InChI InChI=1S/C42H51FN2O8/c1-29(2)40-39(42(49)44-34-16-10-30(11-17-34)7-6-21-50-23-25-52-26-24-51-22-20-46)38(31-8-4-3-5-9-31)41(32-12-14-33(43)15-13-32)45(40)19-18-36-27-35(47)28-37(48)53-36/h3-5,8-17,29,35-36,46-47H,6-7,18-28H2,1-2H3,(H,44,49)/t35-,36-/m1/s1
InChIKey IRESDCWVKSECAI-LQFQNGICSA-N
Mol Weight 730.9 g/mol
Molecular Formula C42H51FN2O8
Exact Mass 730.362945 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID G24CrXE3z2
Name #34;5-(4-FLUOROPHENYL)-1-[2-[(2R,4R)-4-HYDROXY-6-OXOTETRAHYDRO-2H-PYRAN-2-YL]-ETHYL]-N-[4-[3-[2-[2-(2-HYDROXYETHOXY)-ETHOXY]-ETHOXY]-PROPYL]-PHENYL]-2-ISOPROPY
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C42H51FN2O8
InChI InChI=1S/C42H51FN2O8/c1-29(2)40-39(42(49)44-34-16-10-30(11-17-34)7-6-21-50-23-25-52-26-24-51-22-20-46)38(31-8-4-3-5-9-31)41(32-12-14-33(43)15-13-32)45(40)19-18-36-27-35(47)28-37(48)53-36/h3-5,8-17,29,35-36,46-47H,6-7,18-28H2,1-2H3,(H,44,49)/t35-,36-/m1/s1
InChIKey IRESDCWVKSECAI-LQFQNGICSA-N
Literature Reference Author P.SAWANT,M.E.MAIER
Literature Reference Citation EUR.J.ORG.CHEM.,2012,6576(2012)
Molecular Weight 730.874 g/mol
Solvent CDCl3
Source File Reference UWLU83692