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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 KpSs5h69Yzf
Name Confluentic acid
CAS Registry Number 6009-12-7
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. 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
Instrument Name Jeol FX-100
Literature Reference E.G. Sundholm, S. Huneck, Chemica Scripta 16, 197 (1980).
NMR Standard Acetone-D6
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent Acetone-D6