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METHYL_7-HYDROXYANODENDROATE
SpectraBase Compound ID J55uTeaHjuj
InChI InChI=1S/C13H16O5/c1-13(2,16)10-6-7-4-8(12(15)17-3)5-9(14)11(7)18-10/h4-5,10,14,16H,6H2,1-3H3/t10-/m0/s1
InChIKey GWIWUNNGBFPKEN-JTQLQIEISA-N
Mol Weight 252.27 g/mol
Molecular Formula C13H16O5
Exact Mass 252.099774 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2gu7mX7Ns3z
Name METHYL_7-HYDROXYANODENDROATE
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H16O5
InChI InChI=1S/C13H16O5/c1-13(2,16)10-6-7-4-8(12(15)17-3)5-9(14)11(7)18-10/h4-5,10,14,16H,6H2,1-3H3/t10-/m0/s1
InChIKey GWIWUNNGBFPKEN-JTQLQIEISA-N
Literature Reference Author H.Y.HUANG,T.ISHIKAWA,C.F.PENG,I.L.TSAI,I.S.CHEN
Literature Reference Citation J.NAT.PROD.,71,1146(2008)
Literature Reference DOI 10.1021/np700719e
Molecular Weight 252.267 g/mol
Sample ID 28589
Solvent CDCl3