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1,1,2,6,6-PENTABROMO-1,4-OCTADIEN-3-ONE
SpectraBase Compound ID Ftfe7TQH8Og
InChI InChI=1S/C8H7Br5O/c1-2-8(12,13)4-3-5(14)6(9)7(10)11/h3-4H,2H2,1H3/b4-3+
InChIKey ZLSDUFKJWNYUBQ-ONEGZZNKSA-N
Mol Weight 518.66 g/mol
Molecular Formula C8H7Br5O
Exact Mass 513.64138 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KTk6l7fHCpC
Name 1,1,2,6,6-PENTABROMO-1,4-OCTADIEN-3-ONE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C8H7Br5O
InChI InChI=1S/C8H7Br5O/c1-2-8(12,13)4-3-5(14)6(9)7(10)11/h3-4H,2H2,1H3/b4-3+
InChIKey ZLSDUFKJWNYUBQ-ONEGZZNKSA-N
Literature Reference Author S.NAYLOR,L.V.MANES,P.CREWS
Literature Reference Citation J.NAT.PROD.,48,72(1985)
Literature Reference DOI 10.1021/np50037a013
Molecular Weight 518.663 g/mol
Solvent Unknown
Source File Reference UWCS3482