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2E-PHYT-2-ENYL-PHYTANOATE
SpectraBase Compound ID GHOJHQwILev
InChI InChI=1S/C40H78O2/c1-32(2)17-11-19-34(5)21-13-23-36(7)25-15-27-38(9)29-30-42-40(41)31-39(10)28-16-26-37(8)24-14-22-35(6)20-12-18-33(3)4/h29,32-37,39H,11-28,30-31H2,1-10H3/b38-29+
InChIKey ISDYVIZHUSBMJA-DMFHDPHMSA-N
Mol Weight 591.1 g/mol
Molecular Formula C40H78O2
Exact Mass 590.600182 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BAFeZql6hAf
Name 2E-PHYT-2-ENYL-PHYTANOATE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C40H78O2
InChI InChI=1S/C40H78O2/c1-32(2)17-11-19-34(5)21-13-23-36(7)25-15-27-38(9)29-30-42-40(41)31-39(10)28-16-26-37(8)24-14-22-35(6)20-12-18-33(3)4/h29,32-37,39H,11-28,30-31H2,1-10H3/b38-29+
InChIKey ISDYVIZHUSBMJA-DMFHDPHMSA-N
Literature Reference Author M.S.BUCHANAN,T.HASHIMOTO,Y.ASAKAWA
Literature Reference Citation PHYTOCHEM.,41,1373(1996)
Literature Reference DOI 10.1016/0031-9422(95)00760-1
Molecular Weight 591.058 g/mol
Solvent CDCl3
Source File Reference UWLU4397