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VIOLAPYRONE_A;4-HYDROXY-3-METHYL-6-(4-METHYLPENTYL)-2-H-PYRAN-2-ONE
SpectraBase Compound ID AFNtYGEqoE9
InChI InChI=1S/C12H18O3/c1-8(2)5-4-6-10-7-11(13)9(3)12(14)15-10/h7-8,13H,4-6H2,1-3H3
InChIKey PWPBTWIUAZEBGE-UHFFFAOYSA-N
Mol Weight 210.27 g/mol
Molecular Formula C12H18O3
Exact Mass 210.125594 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Glxjbh8wukY
Name VIOLAPYRONE_A;4-HYDROXY-3-METHYL-6-(4-METHYLPENTYL)-2-H-PYRAN-2-ONE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H18O3
InChI InChI=1S/C12H18O3/c1-8(2)5-4-6-10-7-11(13)9(3)12(14)15-10/h7-8,13H,4-6H2,1-3H3
InChIKey PWPBTWIUAZEBGE-UHFFFAOYSA-N
Literature Reference Author J.ZHANG,Y.JIANG,Y.CAO,J.LIU,D.ZHENG,X.CHEN,L.HAN,C.JIANG,X.H UANG
Literature Reference Citation J.NAT.PROD.,76,2126(2013)
Literature Reference DOI 10.1021/np4003417
Molecular Weight 210.273 g/mol
Solvent DMSO-D6
Source File Reference UWMZ43664