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LAPACHOYL-JUNICEDRATE-METHYLESTER

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LAPACHOYL-JUNICEDRATE-METHYLESTER
SpectraBase Compound ID BJNrZ93HfDm
InChI InChI=1S/C36H46O6/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/h8-9,11-13,23,28-29H,4,10,14-21H2,1-3,5-7H3/t23-,28+,29-,35-,36+/m1/s1
InChIKey BLMLBLYDPIYKQK-XEQKOJHVSA-N
Mol Weight 574.8 g/mol
Molecular Formula C36H46O6
Exact Mass 574.329439 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BwMmng4HBxM
Name LAPACHOYL-JUNICEDRATE-METHYLESTER
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C36H46O6
InChI InChI=1S/C36H46O6/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/h8-9,11-13,23,28-29H,4,10,14-21H2,1-3,5-7H3/t23-,28+,29-,35-,36+/m1/s1
InChIKey BLMLBLYDPIYKQK-XEQKOJHVSA-N
Literature Reference Author M.W.PERTINO,C.THEODULOZ,J.A.PALENZUELA,M.DELMARAFONSO,E.YESI LADA,F.MONSALVE,P.GO
Literature Reference Citation MOLECULES,16,8614(2011)
Literature Reference DOI 10.3390/molecules16108614
Molecular Weight 574.758 g/mol
Sample ID 315
Solvent CDCl3