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3'-O-Methylorobol

View entire compound with spectra: 2 NMR, and 1 MS (GC)

3'-O-Methylorobol
SpectraBase Compound ID 1qMxCcDoOXu
InChI InChI=1S/C16H12O6/c1-21-13-4-8(2-3-11(13)18)10-7-22-14-6-9(17)5-12(19)15(14)16(10)20/h2-7,17-19H,1H3
InChIKey ZMFBGWWGXBNJAC-UHFFFAOYSA-N
Mol Weight 300.27 g/mol
Molecular Formula C16H12O6
Exact Mass 300.063388 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KR9ZvI876Ju
Name 3'-O-METHYLOROBOL
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H12O6
InChI InChI=1S/C16H12O6/c1-21-13-4-8(2-3-11(13)18)10-7-22-14-6-9(17)5-12(19)15(14)16(10)20/h2-7,17-19H,1H3
InChIKey ZMFBGWWGXBNJAC-UHFFFAOYSA-N
Literature Reference Author M.D.AWOUAFACK,P.SPITELLER,M.LAMSHOEFT,S.KUSARI,B.IVANOVA,P.T ANE,M.SPITELLER
Literature Reference Citation J.NAT.PROD.,74,272(2011)
Literature Reference DOI 10.1021/np1005218
Molecular Weight 300.268 g/mol
Sample ID 37514
Solvent DMSO-D6