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3(20)-PHYTENE-1,2-DIOL

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3(20)-PHYTENE-1,2-DIOL
SpectraBase Compound ID Bib6c9xTM6n
InChI InChI=1S/2C20H40O2/c2*1-16(2)9-6-10-17(3)11-7-12-18(4)13-8-14-19(5)20(22)15-21/h2*16-18,20-22H,5-15H2,1-4H3/t2*17-,18-,20?/m00/s1
InChIKey VICPJOQXXJCKDU-JRKCAUGHSA-N
Mol Weight 625.1 g/mol
Molecular Formula C40H80O4
Exact Mass 624.605661 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID G42d4gMPatQ
Name 3(20)-PHYTENE-1,2-DIOL
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C40H80O4
InChI InChI=1S/2C20H40O2/c2*1-16(2)9-6-10-17(3)11-7-12-18(4)13-8-14-19(5)20(22)15-21/h2*16-18,20-22H,5-15H2,1-4H3/t2*17-,18-,20?/m00/s1
InChIKey VICPJOQXXJCKDU-JRKCAUGHSA-N
Literature Reference Author G.D.BROWN
Literature Reference Citation PHYTOCHEM.,36,1553(1994)
Literature Reference DOI 10.1016/S0031-9422(00)89762-9
Molecular Weight 625.073 g/mol
Solvent CDCl3
Source File Reference UWLU26486