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8-O-4/8-O-4-DEHYDRO-TRIFERULIC-ACID
SpectraBase Compound ID 5iULlSjgAq2
InChI InChI=1S/C30H26O12/c1-38-23-13-18(4-8-20(23)31)15-26(29(34)35)42-22-10-6-19(14-25(22)40-3)16-27(30(36)37)41-21-9-5-17(7-11-28(32)33)12-24(21)39-2/h4-16,31H,1-3H3,(H,32,33)(H,34,35)(H,36,37)/b11-7+,26-15-,27-16-
InChIKey UWXGIJKBCAIMFK-XVAVVJJYSA-N
Mol Weight 578.53 g/mol
Molecular Formula C30H26O12
Exact Mass 578.142426 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LNYwyNXOsFk
Name 8-O-4/8-O-4-DEHYDRO-TRIFERULIC-ACID
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H26O12
InChI InChI=1S/C30H26O12/c1-38-23-13-18(4-8-20(23)31)15-26(29(34)35)42-22-10-6-19(14-25(22)40-3)16-27(30(36)37)41-21-9-5-17(7-11-28(32)33)12-24(21)39-2/h4-16,31H,1-3H3,(H,32,33)(H,34,35)(H,36,37)/b11-7+,26-15-,27-16-
InChIKey UWXGIJKBCAIMFK-XVAVVJJYSA-N
Literature Reference Author C.FUNK,J.RALPH,H.STEINHART,M.BUNZEL
Literature Reference Citation PHYTOCHEM.,66,363(2005)
Literature Reference DOI 10.1016/j.phytochem.2004.12.008
Molecular Weight 578.529 g/mol
Solvent ACETONE-D6
Source File Reference UWVN29712