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4-Amino-3-phenyliodoniocoumarin tosylate
SpectraBase Compound ID 5Fa4CLKJCiv
InChI InChI=1S/C15H10INO2.C7H8O3S/c17-14-11-8-4-5-9-12(11)19-15(18)13(14)16-10-6-2-1-3-7-10;1-6-2-4-7(5-3-6)11(8,9)10/h1-9H,(H-,17,18);2-5H,1H3,(H,8,9,10)
InChIKey WYAZXHBYZQGVAS-UHFFFAOYSA-N
Mol Weight 535.35 g/mol
Molecular Formula C22H18INO5S
Exact Mass 534.995039 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2uHPAiEKzQ
Name 4-Amino-3-phenyliodoniocoumarin tosylate
Alternate Name(s) (4-amino-2-oxo-2H-chromen-3-yl)(phenyl)iodonium 4-methylbenzenesulfonate (4-amino-2-oxo-1-benzopyran-3-yl)-phenyliodonium;4-methylbenzenesulfonate (4-amino-2-oxochromen-3-yl)-phenyliodanium;4-methylbenzenesulfonate (4-amino-2-oxo-chromen-3-yl)-phenyl-iodonium;4-methylbenzenesulfonate (4-azanyl-2-oxidanylidene-chromen-3-yl)-phenyl-iodanium;4-methylbenzenesulfonate
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Formula C22H18INO5S
InChI InChI=1S/C15H10INO2.C7H8O3S/c17-14-11-8-4-5-9-12(11)19-15(18)13(14)16-10-6-2-1-3-7-10;1-6-2-4-7(5-3-6)11(8,9)10/h1-9H,(H-,17,18);2-5H,1H3,(H,8,9,10)
InChIKey WYAZXHBYZQGVAS-UHFFFAOYSA-N
Molecular Weight 535.352 g/mol
SMILES c1(S([O-])(=O)=O)ccc(cc1)C.NC1=C(C(Oc2ccccc12)=O)[I+]c1ccccc1
SPLASH splash10-0m30-0956000000-d9d40a0530d2c4a8f325
Source of Spectrum Y-33-580-4
Wiley ID 1403924