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LOPHIRONE_F_HEXAMETHYLESTER
SpectraBase Compound ID 5b5lRNOPDnM
InChI InChI=1S/C36H36O9/c1-39-23-11-7-21(8-12-23)35-31(33(37)27-17-15-25(41-3)19-29(27)43-5)32(36(45-35)22-9-13-24(40-2)14-10-22)34(38)28-18-16-26(42-4)20-30(28)44-6/h7-20,31-32,35-36H,1-6H3/t31-,32-,35-,36+/m1/s1
InChIKey IIMAIGJCXBPRFE-UFJXAAJKSA-N
Mol Weight 612.7 g/mol
Molecular Formula C36H36O9
Exact Mass 612.235933 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HN860dXtflX
Name LOPHIRONE_F_HEXAMETHYLESTER
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C36H36O9
InChI InChI=1S/C36H36O9/c1-39-23-11-7-21(8-12-23)35-31(33(37)27-17-15-25(41-3)19-29(27)43-5)32(36(45-35)22-9-13-24(40-2)14-10-22)34(38)28-18-16-26(42-4)20-30(28)44-6/h7-20,31-32,35-36H,1-6H3/t31-,32-,35-,36+/m1/s1
InChIKey IIMAIGJCXBPRFE-UFJXAAJKSA-N
Literature Reference Author R.G.TIH,B.L.SONDENGAM,M.T.MARTIN,B.BODO
Literature Reference Citation PHYTOCHEM.,29,2289(1990)
Literature Reference DOI 10.1016/0031-9422(90)83054-5
Molecular Weight 612.676 g/mol
Solvent ACETONE-D6
Source File Reference UWMZ22454