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N-(4-Chlorophenylsulfonylimino)-2,3,6-trichloro-1,4-benzoquinone
SpectraBase Compound ID BIkg9MJTmOG
InChI InChI=1S/C12H5Cl4NO3S/c13-6-1-3-7(4-2-6)21(19,20)17-12-8(14)5-9(18)10(15)11(12)16/h1-5H/b17-12+
InChIKey HEVDXLWPBVQIMJ-SFQUDFHCSA-N
Mol Weight 385.0 g/mol
Molecular Formula C12H5Cl4NO3S
Exact Mass 382.874425 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3FLHc6Gfkh3
Name N-(4-Chlorophenylsulfonylimino)-2,3,6-trichloro-1,4-benzoquinone
Alternate Name(s) 4-Chloro-N-[(1E)-2,3,6-trichloro-4-oxo-2,5-cyclohexadien-1-ylidene]benzenesulfonamide
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Formula C12H5Cl4NO3S
InChI InChI=1S/C12H5Cl4NO3S/c13-6-1-3-7(4-2-6)21(19,20)17-12-8(14)5-9(18)10(15)11(12)16/h1-5H/b17-12+
InChIKey HEVDXLWPBVQIMJ-SFQUDFHCSA-N
Molecular Weight 385.048 g/mol
SMILES C=1(\C(C(=CC(C1Cl)=O)Cl)=N\S(c1ccc(cc1)Cl)(=O)=O)Cl
SPLASH splash10-004i-0904000000-8db5544bea13a4354445
Source of Spectrum O1-36-1189-2
Wiley ID 819952