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1-METHOXY-3(1H)-1,2-BENZIODOXOLE-3-IMINIUM-TRIFLATE

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1-METHOXY-3(1H)-1,2-BENZIODOXOLE-3-IMINIUM-TRIFLATE
SpectraBase Compound ID 2WV95MKSkL4
InChI InChI=1S/C8H8INO2.CHF3O3S/c1-11-9-7-5-3-2-4-6(7)8(10)12-9;2-1(3,4)8(5,6)7/h2-5,10H,1H3;(H,5,6,7)
InChIKey BUUYVKPJEKHRPJ-UHFFFAOYSA-N
Mol Weight 427.13 g/mol
Molecular Formula C9H9F3INO5S
Exact Mass 426.919823 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9jOd0dvPcO4
Name 1-METHOXY-3(1H)-1,2-BENZIODOXOLE-3-IMINIUM-TRIFLATE
Compound Number 11A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H9F3INO5S
InChI InChI=1S/C8H8INO2.CHF3O3S/c1-11-9-7-5-3-2-4-6(7)8(10)12-9;2-1(3,4)8(5,6)7/h2-5,10H,1H3;(H,5,6,7)
InChIKey BUUYVKPJEKHRPJ-UHFFFAOYSA-N
Literature Reference Author V.V.ZHDANKIN,R.M.ARBIT,J.LYNCH,P.KIPROF,V.G.YOUNG
Literature Reference Citation J.ORG.CHEM.,63,6590(1998)
Literature Reference DOI 10.1021/jo980745b
Solvent CD3CN
Source File Reference UWLU37655