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N-DIOCTYL-2,2',3,3',4,4'-HEXAHYDROXYBIPHENYL-6,6'-DICARBOXYLATE
SpectraBase Compound ID GcAVZXuYYt0
InChI InChI=1S/C30H42O10/c1-3-5-7-9-11-13-15-39-29(37)19-17-21(31)25(33)27(35)23(19)24-20(18-22(32)26(34)28(24)36)30(38)40-16-14-12-10-8-6-4-2/h17-18,31-36H,3-16H2,1-2H3
InChIKey PMBQYBNYQFOYGO-UHFFFAOYSA-N
Mol Weight 562.7 g/mol
Molecular Formula C30H42O10
Exact Mass 562.277798 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3wyCPRir00e
Name N-DIOCTYL-2,2',3,3',4,4'-HEXAHYDROXYBIPHENYL-6,6'-DICARBOXYLATE
Compound Number 15
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H42O10
InChI InChI=1S/C30H42O10/c1-3-5-7-9-11-13-15-39-29(37)19-17-21(31)25(33)27(35)23(19)24-20(18-22(32)26(34)28(24)36)30(38)40-16-14-12-10-8-6-4-2/h17-18,31-36H,3-16H2,1-2H3
InChIKey PMBQYBNYQFOYGO-UHFFFAOYSA-N
Literature Reference Author I.ABE,Y.KASHIWAGI,H.NOGUCHI,T.TANAKA,Y.IKESHIRO,Y.KASHIWADA
Literature Reference Citation J.NAT.PROD.,64,1010(2001)
Literature Reference DOI 10.1021/np010100y
Molecular Weight 562.657 g/mol
Solvent ACETONE-D6:D2O
Source File Reference UWSI1720