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DIHYDROPRENYL-5,6,7,8-TETRAHYDRO-LAPACHOYL-DELTA-8(9)-JUNICEDRATE-METHYLESTER
SpectraBase Compound ID 7Gg79NJhZ7N
InChI InChI=1S/C36H52O6/c1-22(2)13-16-27-31(38)25-11-8-9-12-26(25)32(39)33(27)42-30(37)21-23(3)14-17-28-24(4)15-18-29-35(28,5)19-10-20-36(29,6)34(40)41-7/h22-23,29H,8-21H2,1-7H3/t23-,29-,35-,36+/m1/s1
InChIKey MQQDHVRWSOJGJE-WUMKFESUSA-N
Mol Weight 580.8 g/mol
Molecular Formula C36H52O6
Exact Mass 580.376389 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6yQTuUNvzrz
Name DIHYDROPRENYL-5,6,7,8-TETRAHYDRO-LAPACHOYL-DELTA-8(9)-JUNICEDRATE-METHYLESTER
Compound Number 24
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C36H52O6
InChI InChI=1S/C36H52O6/c1-22(2)13-16-27-31(38)25-11-8-9-12-26(25)32(39)33(27)42-30(37)21-23(3)14-17-28-24(4)15-18-29-35(28,5)19-10-20-36(29,6)34(40)41-7/h22-23,29H,8-21H2,1-7H3/t23-,29-,35-,36+/m1/s1
InChIKey MQQDHVRWSOJGJE-WUMKFESUSA-N
Literature Reference Author C.THEODULOZ,I.BRAVO,M.W.PERTINO,G.SCHMEDA-HIRSCHMANN
Literature Reference Citation MOLECULES,18,11044(2013)
Literature Reference DOI 10.3390/molecules180911044
Molecular Weight 580.805 g/mol
Solvent CDCl3
Source File Reference UWIR9372