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2'-O-[1-(2-FLUOROPHENYL)-4-METHOXYPIPERIDIN-4-YL]-N-1,N-3-BIS-(PIVALOYLOXYMETHYL)-PSEUDOURIDINE
SpectraBase Compound ID 7AxP6Tfk0lN
InChI InChI=1S/C33H46FN3O11/c1-31(2,3)28(41)45-18-36-16-20(27(40)37(30(36)43)19-46-29(42)32(4,5)6)25-26(24(39)23(17-38)47-25)48-33(44-7)12-14-35(15-13-33)22-11-9-8-10-21(22)34/h8-11,16,23-26,38-39H,12-15,17-19H2,1-7H3/t23-,24-,25+,26-/m0/s1
InChIKey YJEVCSUFJDIPCW-SSUZURRFSA-N
Mol Weight 679.7 g/mol
Molecular Formula C33H46FN3O11
Exact Mass 679.311637 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6XJwlbBkTmM
Name 2'-O-[1-(2-FLUOROPHENYL)-4-METHOXYPIPERIDIN-4-YL]-N-1,N-3-BIS-(PIVALOYLOXYMETHYL)-PSEUDOURIDINE
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C33H46FN3O11
InChI InChI=1S/C33H46FN3O11/c1-31(2,3)28(41)45-18-36-16-20(27(40)37(30(36)43)19-46-29(42)32(4,5)6)25-26(24(39)23(17-38)47-25)48-33(44-7)12-14-35(15-13-33)22-11-9-8-10-21(22)34/h8-11,16,23-26,38-39H,12-15,17-19H2,1-7H3/t23-,24-,25+,26-/m0/s1
InChIKey YJEVCSUFJDIPCW-SSUZURRFSA-N
Literature Reference Author U.PIELES,B.BEIJER,K.BOHMANN,S.WESTON,S.O'LOUGHLIN,V.ADAM,B.S .SPROAT
Literature Reference Citation J.CHEM.SOC.PERKIN-1,3423(1994)
Literature Reference DOI 10.1039/p19940003423
Molecular Weight 679.740 g/mol
Solvent CDCl3
Source File Reference UWRU4438