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(4S,5R,6S)-4,6-DIBENZYLOXY-5-[(4-METHOXYBENZYL)-OXY]-CYCLOHEX-2-ENONE
SpectraBase Compound ID 8EWvRAlvqAg
InChI InChI=1S/C28H28O5/c1-30-24-14-12-23(13-15-24)20-33-28-26(31-18-21-8-4-2-5-9-21)17-16-25(29)27(28)32-19-22-10-6-3-7-11-22/h2-17,26-28H,18-20H2,1H3/t26-,27+,28+/m1/s1
InChIKey XIBDQHVSQODIHF-PKTNWEFCSA-N
Mol Weight 444.53 g/mol
Molecular Formula C28H28O5
Exact Mass 444.193674 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3Ub9Zdp0QzP
Name (4S,5R,6S)-4,6-DIBENZYLOXY-5-[(4-METHOXYBENZYL)-OXY]-CYCLOHEX-2-ENONE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H28O5
InChI InChI=1S/C28H28O5/c1-30-24-14-12-23(13-15-24)20-33-28-26(31-18-21-8-4-2-5-9-21)17-16-25(29)27(28)32-19-22-10-6-3-7-11-22/h2-17,26-28H,18-20H2,1H3/t26-,27+,28+/m1/s1
InChIKey XIBDQHVSQODIHF-PKTNWEFCSA-N
Literature Reference Author J.K.FAIRWEATHER,M.J.MCDONOUGH,R.V.STICK,D.M.G.TILBROOK
Literature Reference Citation AUSTR.J.CHEM.,57,197(2004)
Literature Reference DOI 10.1071/CH03203
Molecular Weight 444.527 g/mol
Solvent Unknown
Source File Reference UWVN7479