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3-BROMO-6-NITRODIBENZO-[B,D]-THIOPHENE-5,5-DIOXIDE
SpectraBase Compound ID 2qCx6wa0Hut
InChI InChI=1S/C12H6BrNO4S/c13-7-4-5-8-9-2-1-3-10(14(15)16)12(9)19(17,18)11(8)6-7/h1-6H
InChIKey DIBHSBZAMBPKIK-UHFFFAOYSA-N
Mol Weight 340.15 g/mol
Molecular Formula C12H6BrNO4S
Exact Mass 338.920092 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9HOhj00lyuO
Name 3-BROMO-6-NITRODIBENZO-[B,D]-THIOPHENE-5,5-DIOXIDE
Compound Number 6B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H6BrNO4S
InChI InChI=1S/C12H6BrNO4S/c13-7-4-5-8-9-2-1-3-10(14(15)16)12(9)19(17,18)11(8)6-7/h1-6H
InChIKey DIBHSBZAMBPKIK-UHFFFAOYSA-N
Literature Reference Author R.TEODORO,M.SCHEUNEMANN,W.DEUTHER-CONRAD,B.WENZEL,F.M.FASOLI ,C.GOTTI,M.KRANZ,C.K
Literature Reference Citation MOLECULES,20,18387(2015)
Literature Reference DOI 10.3390/molecules201018387
Molecular Weight 340.148 g/mol
Solvent DMSO-D6
Source File Reference UWPA5220