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(2E,2'E)-PHYTENYL-PHYTENOATE;(2E,2'E)-PHYT-2-ENYL-PHYT-2'-ENOATE
SpectraBase Compound ID BPsfEXJ4EEX
InChI InChI=1S/C40H76O2/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/h29,31-37H,11-28,30H2,1-10H3/b38-29+,39-31+
InChIKey XMRPKMHVDLXNMJ-GLDHSVMOSA-N
Mol Weight 589.0 g/mol
Molecular Formula C40H76O2
Exact Mass 588.584532 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1oeeiS6yoTD
Name (2E,2'E)-PHYTENYL-PHYTENOATE;(2E,2'E)-PHYT-2-ENYL-PHYT-2'-ENOATE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C40H76O2
InChI InChI=1S/C40H76O2/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/h29,31-37H,11-28,30H2,1-10H3/b38-29+,39-31+
InChIKey XMRPKMHVDLXNMJ-GLDHSVMOSA-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 589.042 g/mol
Solvent CDCl3
Source File Reference UWLU4396