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3-Phenyliodonio-2-phenylamino-1,4-naphthoquinone tosylate
SpectraBase Compound ID Ims28wF9Dpp
InChI InChI=1S/C22H14INO2.C7H8O3S/c25-21-17-13-7-8-14-18(17)22(26)20(24-16-11-5-2-6-12-16)19(21)23-15-9-3-1-4-10-15;1-6-2-4-7(5-3-6)11(8,9)10/h1-14H;2-5H,1H3,(H,8,9,10)
InChIKey KWCUANUSCYTWNK-UHFFFAOYSA-N
Mol Weight 623.46 g/mol
Molecular Formula C29H22INO5S
Exact Mass 623.026339 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4TopSDoFZX5
Name 3-Phenyliodonio-2-phenylamino-1,4-naphthoquinone tosylate
Alternate Name(s) (3-anilino-1,4-dioxo-1,4-dihydro-2-naphthalenyl)(phenyl)iodonium 4-methylbenzenesulfonate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H22INO5S
InChI InChI=1S/C22H14INO2.C7H8O3S/c25-21-17-13-7-8-14-18(17)22(26)20(24-16-11-5-2-6-12-16)19(21)23-15-9-3-1-4-10-15;1-6-2-4-7(5-3-6)11(8,9)10/h1-14H;2-5H,1H3,(H,8,9,10)
InChIKey KWCUANUSCYTWNK-UHFFFAOYSA-N
Molecular Weight 623.461 g/mol
SMILES c1(S([O-])(=O)=O)ccc(cc1)C.N(C1=C(C(c2c(cccc2)C1=O)=O)[I+]c1ccccc1)c1ccccc1
SPLASH splash10-0v4j-0090100000-3b5bc98abccc8334e2a3
Source of Spectrum F-53-6107-15
Wiley ID 801966