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CONFLUENTINIC-ACID

View entire compound with spectra: 2 NMR, and 2 MS (GC)

CONFLUENTINIC-ACID
SpectraBase Compound ID Lm4LmIFPU1e
InChI InChI=1S/C28H36O8/c1-5-7-9-11-18-14-22(17-24(35-4)26(18)27(31)32)36-28(33)25-19(13-20(29)12-10-8-6-2)15-21(34-3)16-23(25)30/h14-17,30H,5-13H2,1-4H3,(H,31,32)
InChIKey UANVCGQMNRTKGM-UHFFFAOYSA-N
Mol Weight 500.6 g/mol
Molecular Formula C28H36O8
Exact Mass 500.241018 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2YJYtpZnZFN
Name CONFLUENTINIC-ACID
Compound Number 11
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H36O8
InChI InChI=1S/C28H36O8/c1-5-7-9-11-18-14-22(17-24(35-4)26(18)27(31)32)36-28(33)25-19(13-20(29)12-10-8-6-2)15-21(34-3)16-23(25)30/h14-17,30H,5-13H2,1-4H3,(H,31,32)
InChIKey UANVCGQMNRTKGM-UHFFFAOYSA-N
Literature Reference Author E.G.SUNDHOLM,S.HUNECK
Literature Reference Citation CHEM.SCRIPTA,16,197(1980)
Molecular Weight 500.589 g/mol
Solvent ACETONE-D6
Source File Reference UNIW16899