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5-Bromo-1,1,1-trichloro-4-methoxy-3-penten-2-one
SpectraBase Compound ID CGJNqS6saKl
InChI InChI=1S/C6H6BrCl3O2/c1-12-4(3-7)2-5(11)6(8,9)10/h2H,3H2,1H3/b4-2-
InChIKey IQSMBOLRHTVBHU-RQOWECAXSA-N
Mol Weight 296.38 g/mol
Molecular Formula C6H6BrCl3O2
Exact Mass 293.861676 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1K7tKbupkHg
Name 5-Bromo-1,1,1-trichloro-4-methoxy-3-penten-2-one
Alternate Name(s) (Z)-5-bromanyl-1,1,1-tris(chloranyl)-4-methoxy-pent-3-en-2-one (Z)-5-bromo-1,1,1-trichloro-4-methoxy-3-penten-2-one (Z)-5-bromo-1,1,1-trichloro-4-methoxy-pent-3-en-2-one
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Formula C6H6BrCl3O2
InChI InChI=1S/C6H6BrCl3O2/c1-12-4(3-7)2-5(11)6(8,9)10/h2H,3H2,1H3/b4-2-
InChIKey IQSMBOLRHTVBHU-RQOWECAXSA-N
Molecular Weight 296.375 g/mol
SMILES C(C(\C=C\(OC)CBr)=O)(Cl)(Cl)Cl
SPLASH splash10-017i-9460000000-ff4817dd576f1759a863
Source of Spectrum SO-0-1963-1
Wiley ID 878774