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3-HYDROXYCYMOPOLONE

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3-HYDROXYCYMOPOLONE
SpectraBase Compound ID 8duby7HNero
InChI InChI=1S/C16H21BrO4/c1-10(2)5-4-6-16(3,21)9-15(20)11-7-14(19)12(17)8-13(11)18/h5,7-8,18-19,21H,4,6,9H2,1-3H3
InChIKey YBJQYGUPGUBPII-UHFFFAOYSA-N
Mol Weight 357.24 g/mol
Molecular Formula C16H21BrO4
Exact Mass 356.062322 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KgFchUIqnvP
Name 3-HYDROXYCYMOPOLONE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H21BrO4
InChI InChI=1S/C16H21BrO4/c1-10(2)5-4-6-16(3,21)9-15(20)11-7-14(19)12(17)8-13(11)18/h5,7-8,18-19,21H,4,6,9H2,1-3H3
InChIKey YBJQYGUPGUBPII-UHFFFAOYSA-N
Literature Reference Author E.DORTA,J.DARIAS,A.SANMARTIN,M.CUETO
Literature Reference Citation J.NAT.PROD.,65,329(2002)
Literature Reference DOI 10.1021/np010418q
Molecular Weight 357.244 g/mol
Solvent CDCl3
Source File Reference UWSI4037