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3-[(p-Methoxyphenyl)iodonio]-2-amino-1,4-naphthoquinone tosylate
SpectraBase Compound ID CPIVTlfJOwc
InChI InChI=1S/C17H12INO3.C7H8O3S/c1-22-11-8-6-10(7-9-11)18-14-15(19)17(21)13-5-3-2-4-12(13)16(14)20;1-6-2-4-7(5-3-6)11(8,9)10/h2-9H,1H3,(H-,19,20);2-5H,1H3,(H,8,9,10)
InChIKey PKLTUOJFSCLEOC-UHFFFAOYSA-N
Mol Weight 577.39 g/mol
Molecular Formula C24H20INO6S
Exact Mass 577.005604 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LS8lkNEA938
Name 3-[(p-Methoxyphenyl)iodonio]-2-amino-1,4-naphthoquinone tosylate
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Formula C24H20INO6S
InChI InChI=1S/C17H12INO3.C7H8O3S/c1-22-11-8-6-10(7-9-11)18-14-15(19)17(21)13-5-3-2-4-12(13)16(14)20;1-6-2-4-7(5-3-6)11(8,9)10/h2-9H,1H3,(H-,19,20);2-5H,1H3,(H,8,9,10)
InChIKey PKLTUOJFSCLEOC-UHFFFAOYSA-N
Molecular Weight 577.389 g/mol
SMILES c1(S([O-])(=O)=O)ccc(cc1)C.NC1=C(C(c2c(cccc2)C1=O)=O)[I+]c1ccc(cc1)OC
SPLASH splash10-0536-9650000000-e4a1399783baa60e98f0
Source of Spectrum F-53-6106-10
Synonyms (3-amino-1,4-dioxo-1,4-dihydro-2-naphthalenyl)(4-methoxyphenyl)iodonium 4-methylbenzenesulfonate
Wiley ID 801978