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2,4-DIAMINO-5-((4-FLUOROPHENYL)-THIO)-8-METHOXY-5H-CHROMENO-[2,3-B]-PYRIDINE-3-CARBONITRILE
SpectraBase Compound ID Aj333JXMKgY
InChI InChI=1S/C20H15FN4O2S/c1-26-11-4-7-13-15(8-11)27-20-16(17(23)14(9-22)19(24)25-20)18(13)28-12-5-2-10(21)3-6-12/h2-8,18H,1H3,(H4,23,24,25)
InChIKey YQCYWFYDPPBQCL-UHFFFAOYSA-N
Mol Weight 394.42 g/mol
Molecular Formula C20H15FN4O2S
Exact Mass 394.089975 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LDHVGli1axm
Name 2,4-DIAMINO-5-((4-FLUOROPHENYL)-THIO)-8-METHOXY-5H-CHROMENO-[2,3-B]-PYRIDINE-3-CARBONITRILE
Compound Number 1B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H15FN4O2S
InChI InChI=1S/C20H15FN4O2S/c1-26-11-4-7-13-15(8-11)27-20-16(17(23)14(9-22)19(24)25-20)18(13)28-12-5-2-10(21)3-6-12/h2-8,18H,1H3,(H4,23,24,25)
InChIKey YQCYWFYDPPBQCL-UHFFFAOYSA-N
Literature Reference Author S.BANERJEE,J.WANG,S.PFEFFER,D.MA,L.M.PFEFFER,S.A.PATIL,W.LI, D.D.MILLER
Literature Reference Citation MOLECULES,20,17152(2015)
Literature Reference DOI 10.3390/molecules200917152
Solvent DMSO-D6
Source File Reference UWPA5314