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Phenyl-(S,S-diphenylsulfoximidoyl)-iodonium tosylate
SpectraBase Compound ID 2Q0Lh4vwMAL
InChI InChI=1S/C18H15INOS.C7H8O3S/c21-22(17-12-6-2-7-13-17,18-14-8-3-9-15-18)20-19-16-10-4-1-5-11-16;1-6-2-4-7(5-3-6)11(8,9)10/h1-15H;2-5H,1H3,(H,8,9,10)/q+1;/p-1
InChIKey PMALPOBJQHAPDB-UHFFFAOYSA-M
Mol Weight 591.48 g/mol
Molecular Formula C25H22INO4S2
Exact Mass 591.003496 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GpYgvXeE7z9
Name Phenyl-(S,S-diphenylsulfoximidoyl)-iodonium tosylate
Appearance White solid
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Exact Mass 591.003495536 u
Formula C25H22INO4S2
InChI InChI=1S/C18H15INOS.C7H8O3S/c21-22(17-12-6-2-7-13-17,18-14-8-3-9-15-18)20-19-16-10-4-1-5-11-16;1-6-2-4-7(5-3-6)11(8,9)10/h1-15H;2-5H,1H3,(H,8,9,10)/q+1;/p-1
InChIKey PMALPOBJQHAPDB-UHFFFAOYSA-M
Instrument Name Finnigan SSQ Finnigan 7000
Ionization Type EI
Literature Reference DOI 10.1002/anie.201605743
Molecular Weight 591.478 g/mol
Quality 83
Reported Formula C25H22INO4S2
SMILES C1(S([O-])(=O)=O)=CC=C(C=C1)C.C1=CC=CC=C1[I+]N=S(C1=CC=CC=C1)(=O)C1=CC=CC=C1
SPLASH splash10-004i-9310000000-128ef912543de00385fb
Source of Spectrum ACI-55-SM5-3d (DOI: 10.1002/anie.201605743)
Wiley ID 1899273