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2-[2'-(E)-3',7',11',15'-TETRAMETHYLHEXADEC-2-EN-1'-YL]-6-METHYL-1,4-BENZOHYDROQUINONE-DIACETATE
SpectraBase Compound ID 3gDVBTeSLEC
InChI InChI=1S/C31H50O4/c1-22(2)12-9-13-23(3)14-10-15-24(4)16-11-17-25(5)18-19-29-21-30(34-27(7)32)20-26(6)31(29)35-28(8)33/h18,20-24H,9-17,19H2,1-8H3/b25-18+
InChIKey RPJIXRJZUKTUGC-XIEYBQDHSA-N
Mol Weight 486.7 g/mol
Molecular Formula C31H50O4
Exact Mass 486.37091 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID D3VQychN3yR
Name 2-[2'-(E)-3',7',11',15'-TETRAMETHYLHEXADEC-2-EN-1'-YL]-6-METHYL-1,4-BENZOHYDROQUINONE-DIACETATE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H50O4
InChI InChI=1S/C31H50O4/c1-22(2)12-9-13-23(3)14-10-15-24(4)16-11-17-25(5)18-19-29-21-30(34-27(7)32)20-26(6)31(29)35-28(8)33/h18,20-24H,9-17,19H2,1-8H3/b25-18+
InChIKey RPJIXRJZUKTUGC-XIEYBQDHSA-N
Literature Reference Author C.ARECHE,A.SAN-MARTIN,J.ROVIROSA,J.SOTO-DELGADO,R.CONTRERAS
Literature Reference Citation PHYTOCHEM.,70,1315(2009)
Literature Reference DOI 10.1016/j.phytochem.2009.07.017
Molecular Weight 486.736 g/mol
Sample ID 45631
Solvent C6D6