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Docosyl-3, 4-dihydroxy-trans-cinnamate

View entire compound with spectra: 1 NMR, and 1 MS (GC)

Docosyl-3, 4-dihydroxy-trans-cinnamate
SpectraBase Compound ID 1QIYqEaJgBE
InChI InChI=1S/C31H52O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-26-35-31(34)25-23-28-22-24-29(32)30(33)27-28/h22-25,27,32-33H,2-21,26H2,1H3/b25-23+
InChIKey GUWHMEMJBCLEBP-WJTDDFOZSA-N
Mol Weight 488.8 g/mol
Molecular Formula C31H52O4
Exact Mass 488.38656 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1884OySciDo
Name DOCOSYL-3,4-DIHYDROXY-TRANS-CINNAMATE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H52O4
InChI InChI=1S/C31H52O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-26-35-31(34)25-23-28-22-24-29(32)30(33)27-28/h22-25,27,32-33H,2-21,26H2,1H3/b25-23+
InChIKey GUWHMEMJBCLEBP-WJTDDFOZSA-N
Literature Reference Author S.GIBBONS,K.T.MATHEW,A.I.GRAY
Literature Reference Citation PHYTOCHEM.,51,465(1999)
Literature Reference DOI 10.1016/S0031-9422(99)00007-2
Molecular Weight 488.751 g/mol
Solvent CDCl3
Source File Reference UWUC343