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(2S,3R,5R)-2,3-DIBENZOYLOXY-5-HYDROXY-CYCLOHEXANONE-ETHYLENE-DITHIOACETAL
SpectraBase Compound ID FjloCHe6DyX
InChI InChI=1S/C22H22O5S2/c23-17-13-18(26-20(24)15-7-3-1-4-8-15)19(22(14-17)28-11-12-29-22)27-21(25)16-9-5-2-6-10-16/h1-10,17-19,23H,11-14H2/t17-,18-,19+/m0/s1
InChIKey WOFWRWADATYQGN-GBESFXJTSA-N
Mol Weight 430.53 g/mol
Molecular Formula C22H22O5S2
Exact Mass 430.090866 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LCRFaeIey8Z
Name (2S,3R,5R)-2,3-DIBENZOYLOXY-5-HYDROXY-CYCLOHEXANONE-ETHYLENE-DITHIOACETAL
Compound Number 9
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H22O5S2
InChI InChI=1S/C22H22O5S2/c23-17-13-18(26-20(24)15-7-3-1-4-8-15)19(22(14-17)28-11-12-29-22)27-21(25)16-9-5-2-6-10-16/h1-10,17-19,23H,11-14H2/t17-,18-,19+/m0/s1
InChIKey WOFWRWADATYQGN-GBESFXJTSA-N
Literature Reference Author I.F.PELYVAS,M.MADI-PUSKAS,Z.G.TOTH,Z.VARGA,M.HORNYAK,G.BATTA ,F.SZTARICSKAI
Literature Reference Citation J.ANTIBIOTICS,48,683(1995)
Literature Reference DOI 10.7164/antibiotics.48.683
Molecular Weight 430.534 g/mol
Solvent CDCl3
Source File Reference UWSW399