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3-(2-ETHOXY-2-OXO-ETHYLTHIO)-7-FLUORO-3-OXO-3,4-DIHYDROQUINOXALINE-1-OXIDE
SpectraBase Compound ID FBGn61TgCRE
InChI InChI=1S/C12H11FN2O4S/c1-2-19-10(16)6-20-12-11(17)14-8-4-3-7(13)5-9(8)15(12)18/h3-5H,2,6H2,1H3,(H,14,17)
InChIKey LWURBGJDMYCDFI-UHFFFAOYSA-N
Mol Weight 298.29 g/mol
Molecular Formula C12H11FN2O4S
Exact Mass 298.042356 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BcQGuNDryZr
Name 3-(2-ETHOXY-2-OXO-ETHYLTHIO)-7-FLUORO-3-OXO-3,4-DIHYDROQUINOXALINE-1-OXIDE
Compound Number 11D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H11FN2O4S
InChI InChI=1S/C12H11FN2O4S/c1-2-19-10(16)6-20-12-11(17)14-8-4-3-7(13)5-9(8)15(12)18/h3-5H,2,6H2,1H3,(H,14,17)
InChIKey LWURBGJDMYCDFI-UHFFFAOYSA-N
Literature Reference Author J.MAICHROWSKI,M.GJIKAJ,E.G.HUEBNER,B.BERGMANN,I.B.MUELLER,D. E.KAUFMANN
Literature Reference Citation EUR.J.ORG.CHEM.,2013,2091(2013)
Literature Reference DOI 10.1002/ejoc.201201569
Molecular Weight 298.289 g/mol
Solvent DMSO-D6
Source File Reference UWBT17844