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ISOCORDATO-OBLONGIC-ACID-METHYLESTER
SpectraBase Compound ID 18ueZ3CQwIT
InChI InChI=1S/C21H26O6/c1-10(9-14(22)25-6)15-19-13(7-8-21(4,5)27-19)18(24)16-17(23)11(2)12(3)26-20(15)16/h7-8,10-12,24H,9H2,1-6H3/t10-,11-,12+/m1/s1
InChIKey XTKUXKSLSNDPOT-UTUOFQBUSA-N
Mol Weight 374.43 g/mol
Molecular Formula C21H26O6
Exact Mass 374.172939 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BEBzLY2itue
Name ISOCORDATO-OBLONGIC-ACID-METHYLESTER
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H26O6
InChI InChI=1S/C21H26O6/c1-10(9-14(22)25-6)15-19-13(7-8-21(4,5)27-19)18(24)16-17(23)11(2)12(3)26-20(15)16/h7-8,10-12,24H,9H2,1-6H3/t10-,11-,12+/m1/s1
InChIKey XTKUXKSLSNDPOT-UTUOFQBUSA-N
Literature Reference Author H.R.W.DHARMARATNE,D.S.C.PERERA,G.P.K.MARASINGHE,J.JAMIE
Literature Reference Citation PHYTOCHEM.,51,111(1999)
Literature Reference DOI 10.1016/S0031-9422(98)00592-5
Molecular Weight 374.434 g/mol
Solvent CDCl3
Source File Reference UWUC99