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ETHYL_3,4-DIHYDROXY-5-(2-HYDROXY-3-METHYL-3-BUTENYL)-BENZOATE
SpectraBase Compound ID 5DAOeA34q62
InChI InChI=1S/C14H18O5/c1-4-19-14(18)10-5-9(6-11(15)8(2)3)13(17)12(16)7-10/h5,7,11,15-17H,2,4,6H2,1,3H3
InChIKey FBWJQVPCOKDVIM-UHFFFAOYSA-N
Mol Weight 266.29 g/mol
Molecular Formula C14H18O5
Exact Mass 266.115424 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3aTg6NRbOD4
Name ETHYL_3,4-DIHYDROXY-5-(2-HYDROXY-3-METHYL-3-BUTENYL)-BENZOATE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H18O5
InChI InChI=1S/C14H18O5/c1-4-19-14(18)10-5-9(6-11(15)8(2)3)13(17)12(16)7-10/h5,7,11,15-17H,2,4,6H2,1,3H3
InChIKey FBWJQVPCOKDVIM-UHFFFAOYSA-N
Literature Reference Author N.FLORES,I.A.JIMENEZ,A.GIMENEZ,G.RUIZ,D.GUTIERREZ,G.BOURDY,I .L.BAZZOCCHI
Literature Reference Citation J.NAT.PROD.,71,1538(2008)
Literature Reference DOI 10.1021/np800104p
Molecular Weight 266.294 g/mol
Sample ID 29018
Solvent CDCl3