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CROTOHALIMANEIC_ACID
SpectraBase Compound ID Ly9XAvZsGez
InChI InChI=1S/C20H28O3/c1-14-6-7-17-16(5-4-10-20(17,3)18(21)22)19(14,2)11-8-15-9-12-23-13-15/h9,12-14H,4-8,10-11H2,1-3H3,(H,21,22)
InChIKey QSCGVVYGWUHJIU-UHFFFAOYSA-N
Mol Weight 316.44 g/mol
Molecular Formula C20H28O3
Exact Mass 316.203845 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IhvgtFiQytP
Name CROTOHALIMANEIC_ACID
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H28O3
InChI InChI=1S/C20H28O3/c1-14-6-7-17-16(5-4-10-20(17,3)18(21)22)19(14,2)11-8-15-9-12-23-13-15/h9,12-14H,4-8,10-11H2,1-3H3,(H,21,22)
InChIKey QSCGVVYGWUHJIU-UHFFFAOYSA-N
Literature Reference Author S.ROENGSUMRAN,S.PORNPAKAKUL,N.MUANGSIN,P.SANGVANICH,T.NHUJAK ,P.SINGTOTHONG,N.CHA
Literature Reference Citation PLANTA.MED.,70,87(2004)
Literature Reference DOI 10.1055/s-2004-815466
Molecular Weight 316.441 g/mol
Solvent CDCl3
Source File Reference UWMZ48269