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ISOPLOCAMENONE;(E)-7-BROMO-4,6,8-TRICHLORO-2,6-DIMETHYL-OCTA-1,4-DIEN-3-ONE
SpectraBase Compound ID C4f6kntHQkk
InChI InChI=1S/C10H12BrCl3O/c1-6(2)9(15)7(13)4-10(3,14)8(11)5-12/h4,8H,1,5H2,2-3H3/b7-4+/t8-,10+/m1/s1
InChIKey FGDONCJPOYFCKW-IKQLYWNUSA-N
Mol Weight 334.47 g/mol
Molecular Formula C10H12BrCl3O
Exact Mass 331.913711 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 26ikRK6eoy2
Name ISOPLOCAMENONE;(E)-7-BROMO-4,6,8-TRICHLORO-2,6-DIMETHYL-OCTA-1,4-DIEN-3-ONE
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C10H12BrCl3O
InChI InChI=1S/C10H12BrCl3O/c1-6(2)9(15)7(13)4-10(3,14)8(11)5-12/h4,8H,1,5H2,2-3H3/b7-4+/t8-,10+/m1/s1
InChIKey FGDONCJPOYFCKW-IKQLYWNUSA-N
Literature Reference Author M.A.TIMMERS,D.A.DIAS,S.URBAN
Literature Reference Citation MAR.DRUGS,10,2089(2012)
Literature Reference DOI 10.3390/md10092089
Molecular Weight 334.468 g/mol
Source File Reference UWIR6013