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8-8-(CYCLIC)/8-O-4-DEHYDRO-TRIFERULIC-ACID

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8-8-(CYCLIC)/8-O-4-DEHYDRO-TRIFERULIC-ACID
SpectraBase Compound ID 5S7YpjKBaCV
InChI InChI=1S/C30H26O12/c1-39-21-8-14(4-6-19(21)31)9-25(29(35)36)42-24-13-17-16(12-23(24)41-3)10-18(28(33)34)27(30(37)38)26(17)15-5-7-20(32)22(11-15)40-2/h4-13,26-27,31-32H,1-3H3,(H,33,34)(H,35,36)(H,37,38)/b25-9-
InChIKey YANZQRBAPJUYKS-MWYAZZEHSA-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 80dEiMuPfGs
Name 8-8-(CYCLIC)/8-O-4-DEHYDRO-TRIFERULIC-ACID
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H26O12
InChI InChI=1S/C30H26O12/c1-39-21-8-14(4-6-19(21)31)9-25(29(35)36)42-24-13-17-16(12-23(24)41-3)10-18(28(33)34)27(30(37)38)26(17)15-5-7-20(32)22(11-15)40-2/h4-13,26-27,31-32H,1-3H3,(H,33,34)(H,35,36)(H,37,38)/b25-9-
InChIKey YANZQRBAPJUYKS-MWYAZZEHSA-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 UWVN29714