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3-(p-Tolyliodonio)-2-amino-1,4-naphthoquinone tosylate
SpectraBase Compound ID 3mE8KdhdBBi
InChI InChI=1S/C17H12INO2.C7H8O3S/c1-10-6-8-11(9-7-10)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 UYYOADABJLNSMW-UHFFFAOYSA-N
Mol Weight 561.39 g/mol
Molecular Formula C24H20INO5S
Exact Mass 561.010689 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7Y4VBA7TrRf
Name 3-(p-Tolyliodonio)-2-amino-1,4-naphthoquinone tosylate
Alternate Name(s) (3-amino-1,4-dioxo-1,4-dihydro-2-naphthalenyl)(4-methylphenyl)iodonium 4-methylbenzenesulfonate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H20INO5S
InChI InChI=1S/C17H12INO2.C7H8O3S/c1-10-6-8-11(9-7-10)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 UYYOADABJLNSMW-UHFFFAOYSA-N
Molecular Weight 561.390 g/mol
SMILES c1(S([O-])(=O)=O)ccc(cc1)C.NC1=C(C(c2c(cccc2)C1=O)=O)[I+]c1ccc(cc1)C
SPLASH splash10-014i-0090020000-f74e4456034b75399a2c
Source of Spectrum F-53-6105-10
Wiley ID 801980