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(8R,9S)-9-Pivaloyloxyruban-3-one
SpectraBase Compound ID 2GT1KmNXifW
InChI InChI=1S/C23H28N2O4/c1-23(2,3)22(27)29-21(19-11-14-8-10-25(19)13-20(14)26)16-7-9-24-18-6-5-15(28-4)12-17(16)18/h5-7,9,12,14,19,21H,8,10-11,13H2,1-4H3/t14-,19+,21-/m0/s1
InChIKey JGIGQUCWGVIZEM-ZKYUUJBMSA-N
Mol Weight 396.49 g/mol
Molecular Formula C23H28N2O4
Exact Mass 396.204907 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GVqNJLeo6SO
Name (8R,9S)-9-PIVALOYLOXYRUBAN-3-ONE
Compound Number 1E
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H28N2O4
InChI InChI=1S/C23H28N2O4/c1-23(2,3)22(27)29-21(19-11-14-8-10-25(19)13-20(14)26)16-7-9-24-18-6-5-15(28-4)12-17(16)18/h5-7,9,12,14,19,21H,8,10-11,13H2,1-4H3/t14-,19+,21-/m0/s1
InChIKey JGIGQUCWGVIZEM-ZKYUUJBMSA-N
Literature Reference Author P.LANGER,J.FRACKENPOHL,H.M.R.HOFFMANN
Literature Reference Citation J.CHEM.SOC.PERKIN-1,801(1998)
Literature Reference DOI 10.1039/a705561g
Molecular Weight 396.486 g/mol
Solvent CDCl3
Source File Reference UWGE3104