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(2R,8R,9S)-2,9-EPOXY-2-ISOBUTYRYLRUBAN-3-ONE

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(2R,8R,9S)-2,9-EPOXY-2-ISOBUTYRYLRUBAN-3-ONE
SpectraBase Compound ID LAvT9pwL7hM
InChI InChI=1S/C22H24N2O4/c1-12(2)20(25)22-21(26)13-7-9-24(22)18(10-13)19(28-22)15-6-8-23-17-5-4-14(27-3)11-16(15)17/h4-6,8,11-13,18-19H,7,9-10H2,1-3H3/t13-,18+,19-,22-/m0/s1
InChIKey NBGGDHVXEWOHLO-CDJXCDLFSA-N
Mol Weight 380.44 g/mol
Molecular Formula C22H24N2O4
Exact Mass 380.173607 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ETuwNUKPo4P
Name (2R,8R,9S)-2,9-EPOXY-2-ISOBUTYRYLRUBAN-3-ONE
Compound Number 3D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H24N2O4
InChI InChI=1S/C22H24N2O4/c1-12(2)20(25)22-21(26)13-7-9-24(22)18(10-13)19(28-22)15-6-8-23-17-5-4-14(27-3)11-16(15)17/h4-6,8,11-13,18-19H,7,9-10H2,1-3H3/t13-,18+,19-,22-/m0/s1
InChIKey NBGGDHVXEWOHLO-CDJXCDLFSA-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 380.444 g/mol
Solvent CDCl3
Source File Reference UWGE3116