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PDKGSHDKVRFLJR-UHFFFAOYSA-N
SpectraBase Compound ID P12Ne7EWTd
InChI InChI=1S/C9H12Br2O2/c1-3-4-6(10)7-8(11)5(2)13-9(7)12/h5-6H,3-4H2,1-2H3
InChIKey PDKGSHDKVRFLJR-UHFFFAOYSA-N
Mol Weight 312.0 g/mol
Molecular Formula C9H12Br2O2
Exact Mass 309.920406 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2Kt65LLpOsR
Name 4-BROMO-3-(1-BROMOBUTYL)-5-METHYL-2-(5H)-FURANONE;TWO_DIASTEREOMERS
Compound Number 22B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H12Br2O2
InChI InChI=1S/C9H12Br2O2/c1-3-4-6(10)7-8(11)5(2)13-9(7)12/h5-6H,3-4H2,1-2H3
InChIKey PDKGSHDKVRFLJR-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 312.001 g/mol
Solvent CDCl3
Source File Reference UWGE670