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2-[1-[[2-(benzenesulfonamido)phenyl]thio]cyclopropyl]-2-chloro-acetic acid methyl ester
SpectraBase Compound ID CAyK55Hx5Pj
InChI InChI=1S/C18H18ClNO4S2/c1-24-17(21)16(19)18(11-12-18)25-15-10-6-5-9-14(15)20-26(22,23)13-7-3-2-4-8-13/h2-10,16,20H,11-12H2,1H3
InChIKey OQSSCNPNNSTIFM-UHFFFAOYSA-N
Mol Weight 411.92 g/mol
Molecular Formula C18H18ClNO4S2
Exact Mass 411.036578 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K46XNZljUoi
Name 2-[1-[[2-(benzenesulfonamido)phenyl]thio]cyclopropyl]-2-chloro-acetic acid methyl ester
Alternate Name(s) Methyl 2-chloranyl-2-[1-[2-(phenylsulfonylamino)phenyl]sulfanylcyclopropyl]ethanoate Methyl 2-[1-[2-(benzenesulfonamido)phenyl]sulfanylcyclopropyl]-2-chloro-acetate 2-[1-[[2-(benzenesulfonamido)phenyl]thio]cyclopropyl]-2-chloroacetic acid methyl ester
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Formula C18H18ClNO4S2
InChI InChI=1S/C18H18ClNO4S2/c1-24-17(21)16(19)18(11-12-18)25-15-10-6-5-9-14(15)20-26(22,23)13-7-3-2-4-8-13/h2-10,16,20H,11-12H2,1H3
InChIKey OQSSCNPNNSTIFM-UHFFFAOYSA-N
Molecular Weight 411.918 g/mol
SMILES N(S(=O)(=O)c1ccccc1)c1c(SC2(C(C(=O)OC)Cl)CC2)cccc1
SPLASH splash10-03fr-1963400000-1f24ecc3bfa67cc970c8
Source of Spectrum K1-2003-991-18
Wiley ID 1520836