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1-(5'-ACETYL-2'-METHOXYPHENYL)-3-HYDROXY-3-METHYLBITAN-1-ONE
SpectraBase Compound ID Bk3MIvu2eX
InChI InChI=1S/C14H18O4/c1-9(15)10-5-6-13(18-4)11(7-10)12(16)8-14(2,3)17/h5-7,17H,8H2,1-4H3
InChIKey DAROMUZNSGMNST-UHFFFAOYSA-N
Mol Weight 250.29 g/mol
Molecular Formula C14H18O4
Exact Mass 250.120509 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2srf8cyNI6k
Name 1-(5'-ACETYL-2'-METHOXYPHENYL)-3-HYDROXY-3-METHYLBITAN-1-ONE
Compound Number 12
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H18O4
InChI InChI=1S/C14H18O4/c1-9(15)10-5-6-13(18-4)11(7-10)12(16)8-14(2,3)17/h5-7,17H,8H2,1-4H3
InChIKey DAROMUZNSGMNST-UHFFFAOYSA-N
Literature Reference Author X.FAN,J.ZI,C.ZHU,W.XU,W.CHENG,S.YANG,Y.GUO,J.SHI
Literature Reference Citation J.NAT.PROD.,72,1184(2009)
Literature Reference DOI 10.1021/np900213w
Molecular Weight 250.295 g/mol
Sample ID 33110
Solvent ACETONE-D6