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Sekikaic acid, methyl ester

View entire compound with spectra: 2 NMR, and 1 MS (GC)

Sekikaic acid, methyl ester
SpectraBase Compound ID Ljy09VeVFMI
InChI InChI=1S/C23H28O8/c1-6-8-13-10-15(28-3)12-16(24)18(13)23(27)31-21-17(29-4)11-14(9-7-2)19(20(21)25)22(26)30-5/h10-12,24-25H,6-9H2,1-5H3
InChIKey TVGSPKREJWLKSZ-UHFFFAOYSA-N
Mol Weight 432.47 g/mol
Molecular Formula C23H28O8
Exact Mass 432.178418 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JE3AVnytI6T
Name SEKIKAIC-ACID-METHYLESTER
Compound Number 13
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H28O8
InChI InChI=1S/C23H28O8/c1-6-8-13-10-15(28-3)12-16(24)18(13)23(27)31-21-17(29-4)11-14(9-7-2)19(20(21)25)22(26)30-5/h10-12,24-25H,6-9H2,1-5H3
InChIKey TVGSPKREJWLKSZ-UHFFFAOYSA-N
Literature Reference Author E.G.SUNDHOLM,S.HUNECK
Literature Reference Citation CHEM.SCRIPTA,16,197(1980)
Molecular Weight 432.471 g/mol
Solvent CDCl3
Source File Reference UNIW16901