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N-Phenylsulfonylimino-2,3,6-trichloro-1,4-benzoquinone
SpectraBase Compound ID FgvTJuhUKKA
InChI InChI=1S/C12H6Cl3NO3S/c13-8-6-9(17)10(14)11(15)12(8)16-20(18,19)7-4-2-1-3-5-7/h1-6H/b16-12+
InChIKey ZWWOFDJWZIAPAI-FOWTUZBSSA-N
Mol Weight 350.6 g/mol
Molecular Formula C12H6Cl3NO3S
Exact Mass 348.913397 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5GQb59s5QW
Name N-Phenylsulfonylimino-2,3,6-trichloro-1,4-benzoquinone
Alternate Name(s) N-[(1E)-2,3,6-trichloro-4-oxo-2,5-cyclohexadien-1-ylidene]benzenesulfonamide
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Formula C12H6Cl3NO3S
InChI InChI=1S/C12H6Cl3NO3S/c13-8-6-9(17)10(14)11(15)12(8)16-20(18,19)7-4-2-1-3-5-7/h1-6H/b16-12+
InChIKey ZWWOFDJWZIAPAI-FOWTUZBSSA-N
Molecular Weight 350.603 g/mol
SMILES C=1(\C(C(=CC(C1Cl)=O)Cl)=N\S(=O)(=O)c1ccccc1)Cl
SPLASH splash10-002f-8902000000-14a3539bd60fadb0645a
Source of Spectrum O1-36-1188-2
Wiley ID 819953