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(5-R,6-S)-5,6-DIBENZOYLOXY-2-CYCLOHEXEN-1-ONE
SpectraBase Compound ID OTKK6QLC5T
InChI InChI=1S/C20H16O5/c21-16-12-7-13-17(24-19(22)14-8-3-1-4-9-14)18(16)25-20(23)15-10-5-2-6-11-15/h1-12,17-18H,13H2/t17-,18-/m1/s1
InChIKey UIAYCSGGYRDSAP-QZTJIDSGSA-N
Mol Weight 336.34 g/mol
Molecular Formula C20H16O5
Exact Mass 336.099774 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4NwpziGFpE4
Name (5-R,6-S)-5,6-DIBENZOYLOXY-2-CYCLOHEXEN-1-ONE
Compound Number 14
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H16O5
InChI InChI=1S/C20H16O5/c21-16-12-7-13-17(24-19(22)14-8-3-1-4-9-14)18(16)25-20(23)15-10-5-2-6-11-15/h1-12,17-18H,13H2/t17-,18-/m1/s1
InChIKey UIAYCSGGYRDSAP-QZTJIDSGSA-N
Literature Reference Author I.F.PELYVAS,Z.G.TOTH,G.VEREB,A.BALLA,E.KOVACS,A.GORZSAS,F.SZ TARICSKAI,P.GERGELY
Literature Reference Citation J.MED.CHEM.,44,627(2001)
Literature Reference DOI 10.1021/jm001081c
Molecular Weight 336.344 g/mol
Sample ID 43857
Solvent ACETONE-D6