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acetic acid [4-[(2R,3R)-3,7-diacetoxy-6-[(2E)-3,7-dimethylocta-2,6-dienyl]-4-keto-5-methoxy-chroman-2-yl]phenyl] ester
SpectraBase Compound ID LPpnaAG2oLV
InChI InChI=1S/C32H36O9/c1-18(2)9-8-10-19(3)11-16-25-26(39-21(5)34)17-27-28(31(25)37-7)29(36)32(40-22(6)35)30(41-27)23-12-14-24(15-13-23)38-20(4)33/h9,11-15,17,30,32H,8,10,16H2,1-7H3/b19-11+/t30-,32+/m1/s1
InChIKey NCLFKRVLNJHLJP-DIHRPCISSA-N
Mol Weight 564.6 g/mol
Molecular Formula C32H36O9
Exact Mass 564.235933 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Fv3jojoQI0p
Name acetic acid [4-[(2R,3R)-3,7-diacetoxy-6-[(2E)-3,7-dimethylocta-2,6-dienyl]-4-keto-5-methoxy-chroman-2-yl]phenyl] ester
Compound Number 7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C32H36O9
InChI InChI=1S/C32H36O9/c1-18(2)9-8-10-19(3)11-16-25-26(39-21(5)34)17-27-28(31(25)37-7)29(36)32(40-22(6)35)30(41-27)23-12-14-24(15-13-23)38-20(4)33/h9,11-15,17,30,32H,8,10,16H2,1-7H3/b19-11+/t30-,32+/m1/s1
InChIKey NCLFKRVLNJHLJP-DIHRPCISSA-N
Literature Reference Author M.BRUNO,G.SAVONA,L.LAMARTINA,F.LENTINI
Literature Reference Citation HETEROCYCLES,23,1147(1985)
Literature Reference DOI 10.3987/R-1985-05-1147
Molecular Weight 564.632 g/mol
Solvent CDCl3
Source File Reference UWED6800