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(2R,8R,9S)-2-ACETYL-2,9-EPOXYRUBAN-3-ONE

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(2R,8R,9S)-2-ACETYL-2,9-EPOXYRUBAN-3-ONE
SpectraBase Compound ID ImXL4sKe22B
InChI InChI=1S/C20H20N2O4/c1-11(23)20-19(24)12-6-8-22(20)17(9-12)18(26-20)14-5-7-21-16-4-3-13(25-2)10-15(14)16/h3-5,7,10,12,17-18H,6,8-9H2,1-2H3/t12-,17+,18+,20-/m0/s1
InChIKey CZKULIVYRDMNAC-HVKVTAPKSA-N
Mol Weight 352.39 g/mol
Molecular Formula C20H20N2O4
Exact Mass 352.142307 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GrKVeL9MQ8S
Name (2R,8R,9S)-2-ACETYL-2,9-EPOXYRUBAN-3-ONE
Compound Number 3B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H20N2O4
InChI InChI=1S/C20H20N2O4/c1-11(23)20-19(24)12-6-8-22(20)17(9-12)18(26-20)14-5-7-21-16-4-3-13(25-2)10-15(14)16/h3-5,7,10,12,17-18H,6,8-9H2,1-2H3/t12-,17+,18+,20-/m0/s1
InChIKey CZKULIVYRDMNAC-HVKVTAPKSA-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 352.390 g/mol
Solvent CDCl3
Source File Reference UWGE3114