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1-(3,5-DIBENZYLOXYPHENYL)-2-METHYLHEPTANE-3,5-DIONE

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1-(3,5-DIBENZYLOXYPHENYL)-2-METHYLHEPTANE-3,5-DIONE
SpectraBase Compound ID JMS5vnVGgzw
InChI InChI=1S/C28H30O4/c1-3-25(29)17-28(30)21(2)14-24-15-26(31-19-22-10-6-4-7-11-22)18-27(16-24)32-20-23-12-8-5-9-13-23/h4-13,15-16,18,21H,3,14,17,19-20H2,1-2H3
InChIKey RBCWEUNYUGJMLG-UHFFFAOYSA-N
Mol Weight 430.54 g/mol
Molecular Formula C28H30O4
Exact Mass 430.214409 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9CBM9ZRNSsY
Name 1-(3,5-DIBENZYLOXYPHENYL)-2-METHYLHEPTANE-3,5-DIONE
Compound Number 11
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H30O4
InChI InChI=1S/C28H30O4/c1-3-25(29)17-28(30)21(2)14-24-15-26(31-19-22-10-6-4-7-11-22)18-27(16-24)32-20-23-12-8-5-9-13-23/h4-13,15-16,18,21H,3,14,17,19-20H2,1-2H3
InChIKey RBCWEUNYUGJMLG-UHFFFAOYSA-N
Literature Reference Author J.F.JAMIE,R.W.RICKARDS
Literature Reference Citation J.CHEM.SOC.PERKIN-1,2603(1996)
Literature Reference DOI 10.1039/p19960002603
Molecular Weight 430.544 g/mol
Solvent CDCl3
Source File Reference UWCP8224