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4-bromo-3-(1-bromobutyl)-5-hydroxy-5-methylfuran-2-one
SpectraBase Compound ID ZzbNPkSaQ7
InChI InChI=1S/C9H12Br2O3/c1-3-4-5(10)6-7(11)9(2,13)14-8(6)12/h5,13H,3-4H2,1-2H3
InChIKey FKMMFMFDRJIBRB-UHFFFAOYSA-N
Mol Weight 328.0 g/mol
Molecular Formula C9H12Br2O3
Exact Mass 325.91532 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FGbElmZtyYT
Name 4-bromo-3-(1-bromobutyl)-5-hydroxy-5-methylfuran-2-one
Compound Number 25
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H12Br2O3
InChI InChI=1S/C9H12Br2O3/c1-3-4-5(10)6-7(11)9(2,13)14-8(6)12/h5,13H,3-4H2,1-2H3
InChIKey FKMMFMFDRJIBRB-UHFFFAOYSA-N
Literature Reference Author P.DEMARCH,J.FONT,A.GRACIA,Z.QINGYING
Literature Reference Citation J.ORG.CHEM.,60,1814(1995)
Literature Reference DOI 10.1021/jo00111a045
Molecular Weight 328.000 g/mol
Solvent CDCl3
Source File Reference UWGE672