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BRUCEOLINE_I
SpectraBase Compound ID 1fLL4CmgJI1
InChI InChI=1S/C13H13NO3/c1-13(2)11-9(10(16)12(13)17)7-4-3-6(15)5-8(7)14-11/h3-5,12,14-15,17H,1-2H3/t12-/m0/s1
InChIKey YVCJAXRJLMHQET-LBPRGKRZSA-N
Mol Weight 231.25 g/mol
Molecular Formula C13H13NO3
Exact Mass 231.089543 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 25L77Y8DDSv
Name BRUCEOLINE_I
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H13NO3
InChI InChI=1S/C13H13NO3/c1-13(2)11-9(10(16)12(13)17)7-4-3-6(15)5-8(7)14-11/h3-5,12,14-15,17H,1-2H3/t12-/m0/s1
InChIKey YVCJAXRJLMHQET-LBPRGKRZSA-N
Literature Reference Author H.CHEN,J.BAI,Z.F.FANG,S.S.YU,S.G.MA,S.XU,Y.LI,J.QU,J.H.REN,L .LI,Y.K.SI,X.G.CHEN
Literature Reference Citation J.NAT.PROD.,74,2438(2011)
Literature Reference DOI 10.1021/np200712y
Molecular Weight 231.251 g/mol
Sample ID 39564
Solvent ACETONE-D6