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PESTALAFURANONE-J
SpectraBase Compound ID ADV980yXbCs
InChI InChI=1S/C11H14O3/c1-2-5-10-9(6-3-4-7-12)8-14-11(10)13/h2-3,5-6,12H,4,7-8H2,1H3/b5-2+,6-3+
InChIKey UWSSRVLAQDZZLE-BUSIMMOISA-N
Mol Weight 194.23 g/mol
Molecular Formula C11H14O3
Exact Mass 194.094294 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KAq1NvCvOmJ
Name PESTALAFURANONE-J
Compound Number 7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C11H14O3
InChI InChI=1S/C11H14O3/c1-2-5-10-9(6-3-4-7-12)8-14-11(10)13/h2-3,5-6,12H,4,7-8H2,1H3/b5-2+,6-3+
InChIKey UWSSRVLAQDZZLE-BUSIMMOISA-N
Literature Reference Author H.ZHANG,Z.DENG,Z.GUO,X.TU,J.WANG,K.ZOU
Literature Reference Citation MOLECULES,19,819(2014)
Literature Reference DOI 10.3390/molecules19010819
Molecular Weight 194.230 g/mol
Solvent CDCl3
Source File Reference UWBT14228