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(E)-3-[4-(3-methylbut-2-enoxy)-2,2-di(phenyl)-1,3-benzodioxol-5-yl]acrylic acid methyl ester
SpectraBase Compound ID FguQfyLwhZD
InChI InChI=1S/C28H26O5/c1-20(2)18-19-31-26-21(15-17-25(29)30-3)14-16-24-27(26)33-28(32-24,22-10-6-4-7-11-22)23-12-8-5-9-13-23/h4-18H,19H2,1-3H3/b17-15+
InChIKey NWHNZMVUNBBIFS-BMRADRMJSA-N
Mol Weight 442.51 g/mol
Molecular Formula C28H26O5
Exact Mass 442.178024 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HHCmVtNvMJA
Name (E)-3-[4-(3-methylbut-2-enoxy)-2,2-di(phenyl)-1,3-benzodioxol-5-yl]acrylic acid methyl ester
Compound Number 16
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Formula C28H26O5
InChI InChI=1S/C28H26O5/c1-20(2)18-19-31-26-21(15-17-25(29)30-3)14-16-24-27(26)33-28(32-24,22-10-6-4-7-11-22)23-12-8-5-9-13-23/h4-18H,19H2,1-3H3/b17-15+
InChIKey NWHNZMVUNBBIFS-BMRADRMJSA-N
Literature Reference Author J.REISCH,A.A.W.VOERSTE
Literature Reference Citation J.CHEM.SOC.PERKIN-1,3251(1994)
Literature Reference DOI 10.1039/p19940003251
Molecular Weight 442.511 g/mol
Solvent CDCl3
Source File Reference UWRU4357