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5-Iodo-1,1,1-trichloro-4-methoxy-3-penten-2-one
SpectraBase Compound ID KDkGfWT72FZ
InChI InChI=1S/C6H6Cl3IO2/c1-12-4(3-10)2-5(11)6(7,8)9/h2H,3H2,1H3/b4-2-
InChIKey BBZADAUYOOTBLJ-RQOWECAXSA-N
Mol Weight 343.38 g/mol
Molecular Formula C6H6Cl3IO2
Exact Mass 341.847808 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GRUiactQhE7
Name 5-Iodo-1,1,1-trichloro-4-methoxy-3-penten-2-one
Alternate Name(s) (3Z)-1,1,1-trichloro-5-iodo-4-methoxy-3-penten-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H6Cl3IO2
InChI InChI=1S/C6H6Cl3IO2/c1-12-4(3-10)2-5(11)6(7,8)9/h2H,3H2,1H3/b4-2-
InChIKey BBZADAUYOOTBLJ-RQOWECAXSA-N
Molecular Weight 343.375 g/mol
SMILES C(C(\C=C\(OC)CI)=O)(Cl)(Cl)Cl
SPLASH splash10-00di-0290000000-d01f13a23cdfbd5c1e09
Source of Spectrum SO-0-1963-1
Wiley ID 878765