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(TRANS)-3-[6-[6-[(E)-2-CARBOXYETHENYL]-3-(3,4-DIHYDROXYPHENYL)-2,3-DIHYDRO-2-(1,4-BENZODIOXIN)-3,4-DIHYDROXYPHENYL]-(E)-2-PROPENOIC-ACID
SpectraBase Compound ID FcdOcvIpjlJ
InChI InChI=1S/C26H20O10/c27-17-5-3-15(11-18(17)28)25-26(16-12-20(30)19(29)10-14(16)4-8-24(33)34)36-22-9-13(2-7-23(31)32)1-6-21(22)35-25/h1-12,25-30H,(H,31,32)(H,33,34)/b7-2+,8-4+/t25-,26-/m0/s1
InChIKey GEINCNSTPKZYRL-PPNJNYSUSA-N
Mol Weight 492.44 g/mol
Molecular Formula C26H20O10
Exact Mass 492.105647 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FRI99WyXao7
Name (TRANS)-3-[6-[6-[(E)-2-CARBOXYETHENYL]-3-(3,4-DIHYDROXYPHENYL)-2,3-DIHYDRO-2-(1,4-BENZODIOXIN)-3,4-DIHYDROXYPHENYL]-(E)-2-PROPENOIC-ACID
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H20O10
InChI InChI=1S/C26H20O10/c27-17-5-3-15(11-18(17)28)25-26(16-12-20(30)19(29)10-14(16)4-8-24(33)34)36-22-9-13(2-7-23(31)32)1-6-21(22)35-25/h1-12,25-30H,(H,31,32)(H,33,34)/b7-2+,8-4+/t25-,26-/m0/s1
InChIKey GEINCNSTPKZYRL-PPNJNYSUSA-N
Literature Reference Author X.WAN,H.LIU,X.HUANG,J.LUO,L.KONG
Literature Reference Citation CAN.J.CHEM.,86,821(2008)
Literature Reference DOI 10.1139/v08-090
Molecular Weight 492.439 g/mol
Solvent CD3OD
Source File Reference UWMZ46085