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CASTANOL-C;4-HYDROXY-1-(1-HYDROXY-5-METHYLNAPHTHALEN-2-YL)-3-METHYLBUTAN-1-ONE
SpectraBase Compound ID 18EQMrjdWrG
InChI InChI=1S/C16H18O3/c1-10(9-17)8-15(18)14-7-6-12-11(2)4-3-5-13(12)16(14)19/h3-7,10,17,19H,8-9H2,1-2H3
InChIKey UOEIVDDCFOUBGB-UHFFFAOYSA-N
Mol Weight 258.32 g/mol
Molecular Formula C16H18O3
Exact Mass 258.125594 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6i6TwnwPsas
Name CASTANOL-C;4-HYDROXY-1-(1-HYDROXY-5-METHYLNAPHTHALEN-2-YL)-3-METHYLBUTAN-1-ONE
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H18O3
InChI InChI=1S/C16H18O3/c1-10(9-17)8-15(18)14-7-6-12-11(2)4-3-5-13(12)16(14)19/h3-7,10,17,19H,8-9H2,1-2H3
InChIKey UOEIVDDCFOUBGB-UHFFFAOYSA-N
Literature Reference Author Z.H.PAN,Y.LI,X.D.WU,J.HE,X.Q.CHEN,G.XU,L.Y.PENG,Q.S.ZHAO
Literature Reference Citation FITOTERAPIA,83,1072(2012)
Literature Reference DOI 10.1016/j.fitote.2012.05.005
Molecular Weight 258.317 g/mol
Sample ID 71988
Solvent CDCl3