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1,3,5-TRIACETOXY-2,6-DI-(3-METHYL-2-BUTEN-1-YL)-BENZENE
SpectraBase Compound ID J1dp975eUTL
InChI InChI=1S/C22H28O6/c1-13(2)8-10-18-20(26-15(5)23)12-21(27-16(6)24)19(11-9-14(3)4)22(18)28-17(7)25/h8-9,12H,10-11H2,1-7H3
InChIKey NNSMTWNQJWPCQH-UHFFFAOYSA-N
Mol Weight 388.46 g/mol
Molecular Formula C22H28O6
Exact Mass 388.188589 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4tjswqsgJ1O
Name 1,3,5-TRIACETOXY-2,6-DI-(3-METHYL-2-BUTEN-1-YL)-BENZENE
Compound Number 31
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H28O6
InChI InChI=1S/C22H28O6/c1-13(2)8-10-18-20(26-15(5)23)12-21(27-16(6)24)19(11-9-14(3)4)22(18)28-17(7)25/h8-9,12H,10-11H2,1-7H3
InChIKey NNSMTWNQJWPCQH-UHFFFAOYSA-N
Literature Reference Author M.OSORIO,J.ARAVENA,A.VERGARA,L.TABORGA,E.BAEZA,K.CATALAN,C.G ONZALEZ,M.CARVAJAL,H
Literature Reference Citation MOLECULES,17,556(2012)
Literature Reference DOI 10.3390/molecules17010556
Molecular Weight 388.461 g/mol
Sample ID 72975
Solvent CDCl3