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2,6-Dihydroxy-3-acetyl-5-nitro-phenyliodonium trifluoroacetate
SpectraBase Compound ID C32nVJ8v4QF
InChI InChI=1S/C14H10INO5.C2HF3O2/c1-8(17)10-7-11(16(20)21)14(19)12(13(10)18)15-9-5-3-2-4-6-9;3-2(4,5)1(6)7/h2-7H,1H3,(H-,17,18,19);(H,6,7)
InChIKey DOYNATOOYFKDKC-UHFFFAOYSA-N
Mol Weight 513.16 g/mol
Molecular Formula C16H11F3INO7
Exact Mass 512.953231 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2HwNy2dGvyV
Name 2,6-Dihydroxy-3-acetyl-5-nitro-phenyliodonium trifluoroacetate
Alternate Name(s) (2,6-Dihydroxy-3-acetyl-5-nitro-phenyl)-phenyl-iodonium trifluoroacetate (3-acetyl-2,6-dihydroxy-5-nitrophenyl)(phenyl)iodonium trifluoroacetate
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Formula C16H11F3INO7
InChI InChI=1S/C14H10INO5.C2HF3O2/c1-8(17)10-7-11(16(20)21)14(19)12(13(10)18)15-9-5-3-2-4-6-9;3-2(4,5)1(6)7/h2-7H,1H3,(H-,17,18,19);(H,6,7)
InChIKey DOYNATOOYFKDKC-UHFFFAOYSA-N
Molecular Weight 513.164 g/mol
SMILES C(C([O-])=O)(F)(F)F.Oc1c(c(c(cc1C(=O)C)N(=O)=O)O)[I+]c1ccccc1
SPLASH splash10-004i-9562000000-b48b9277346fd8a430ca
Source of Spectrum F-50-11550-17
Wiley ID 789438