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4-Chloro-2-[p-(fluorosulfonyl)phenyl]-6-quinolinesulfonyl fluoride
SpectraBase Compound ID LJ7vt7szlh2
InChI InChI=1S/C15H8ClF2NO4S2/c16-13-8-15(9-1-3-10(4-2-9)24(17,20)21)19-14-6-5-11(7-12(13)14)25(18,22)23/h1-8H
InChIKey WQNRQOZBUZSRKB-UHFFFAOYSA-N
Mol Weight 403.8 g/mol
Molecular Formula C15H8ClF2NO4S2
Exact Mass 402.955134 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8N5MxpecEHg
Name 4-Chloro-2-[p-(fluorosulfonyl)phenyl]-6-quinolinesulfonyl fluoride
Comments Computed using HOSE algorithm
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Exact Mass 402.955134112 u
Formula C15H8ClF2NO4S2
InChI InChI=1S/C15H8ClF2NO4S2/c16-13-8-15(9-1-3-10(4-2-9)24(17,20)21)19-14-6-5-11(7-12(13)14)25(18,22)23/h1-8H
InChIKey WQNRQOZBUZSRKB-UHFFFAOYSA-N
Molecular Weight 403.802 g/mol
SMILES C=12C=C(C=CC1N=C(C=C2Cl)C=1C=CC(=CC1)S(=O)(=O)F)S(=O)(=O)F