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(2E,4E,7S,8E,10E,12E,14S)-7,9,13,17-TETRAMETHYL-7,14-DIHYDROXY-2,4,8,10,12,16-OCTADECAHEXAENOIC-ACID
SpectraBase Compound ID 1j8pe6AozDf
InChI InChI=1S/C22H32O4/c1-17(2)13-14-20(23)19(4)11-9-10-18(3)16-22(5,26)15-8-6-7-12-21(24)25/h6-13,16,20,23,26H,14-15H2,1-5H3,(H,24,25)/b8-6+,10-9+,12-7+,18-16+,19-11+/t20-,22+/m1/s1
InChIKey AJIPQLGQGAHQQV-XFEIRVDESA-N
Mol Weight 360.5 g/mol
Molecular Formula C22H32O4
Exact Mass 360.23006 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9QJfS37Mgkx
Name (2E,4E,7S,8E,10E,12E,14S)-7,9,13,17-TETRAMETHYL-7,14-DIHYDROXY-2,4,8,10,12,16-OCTADECAHEXAENOIC-ACID
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H32O4
InChI InChI=1S/C22H32O4/c1-17(2)13-14-20(23)19(4)11-9-10-18(3)16-22(5,26)15-8-6-7-12-21(24)25/h6-13,16,20,23,26H,14-15H2,1-5H3,(H,24,25)/b8-6+,10-9+,12-7+,18-16+,19-11+/t20-,22+/m1/s1
InChIKey AJIPQLGQGAHQQV-XFEIRVDESA-N
Literature Reference Author T.REZANKA
Literature Reference Citation PHYTOCHEM.,60,639(2002)
Literature Reference DOI 10.1016/S0031-9422(02)00159-0
Molecular Weight 360.494 g/mol
Solvent C5D5N:CD3OD=1:1
Source File Reference UWMS1759