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MICROMELOSIDE-C;7-METHOXY-8-(1'-METHOXY-2',4'-DIHYDRO-3'-METHYLENE-4'-O-ISOVALERYL-BUTYL)-COUMARIN
SpectraBase Compound ID LOnQujEEolM
InChI InChI=1S/C21H26O7/c1-12(2)10-17(23)27-11-13(3)19(24)21(26-5)18-15(25-4)8-6-14-7-9-16(22)28-20(14)18/h6-9,12,19,21,24H,3,10-11H2,1-2,4-5H3
InChIKey HLFPSWFPQUPSTQ-UHFFFAOYSA-N
Mol Weight 390.43 g/mol
Molecular Formula C21H26O7
Exact Mass 390.167853 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KN1DWi8T1OL
Name MICROMELOSIDE-C;7-METHOXY-8-(1'-METHOXY-2',4'-DIHYDRO-3'-METHYLENE-4'-O-ISOVALERYL-BUTYL)-COUMARIN
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H26O7
InChI InChI=1S/C21H26O7/c1-12(2)10-17(23)27-11-13(3)19(24)21(26-5)18-15(25-4)8-6-14-7-9-16(22)28-20(14)18/h6-9,12,19,21,24H,3,10-11H2,1-2,4-5H3
InChIKey HLFPSWFPQUPSTQ-UHFFFAOYSA-N
Literature Reference Author X.LUO,S.QI,H.YIN,Z.XIAO,S.ZHANG
Literature Reference Citation MAGN.RES.CHEM.,47,1110(2009)
Literature Reference DOI 10.1002/mrc.2517
Molecular Weight 390.433 g/mol
Solvent DMSO-D6
Source File Reference UWLU80213