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9-(4-FLUOROPHENYLAMINO)-THIAZOLO-[5,4-F]-QUINAZOLINE-2-CARBONITRILE
SpectraBase Compound ID A7dP3pSu7d7
InChI InChI=1S/C16H8FN5S/c17-9-1-3-10(4-2-9)21-16-14-11(19-8-20-16)5-6-12-15(14)23-13(7-18)22-12/h1-6,8H,(H,19,20,21)
InChIKey JTWOXKJJAVFKHP-UHFFFAOYSA-N
Mol Weight 321.33 g/mol
Molecular Formula C16H8FN5S
Exact Mass 321.048445 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8EUdx1xmZ50
Name 9-(4-FLUOROPHENYLAMINO)-THIAZOLO-[5,4-F]-QUINAZOLINE-2-CARBONITRILE
Compound Number 5E
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H8FN5S
InChI InChI=1S/C16H8FN5S/c17-9-1-3-10(4-2-9)21-16-14-11(19-8-20-16)5-6-12-15(14)23-13(7-18)22-12/h1-6,8H,(H,19,20,21)
InChIKey JTWOXKJJAVFKHP-UHFFFAOYSA-N
Literature Reference Author A.FOUCOURT,D.HEDOU,C.DUBOUILH-BENARD,A.GIRARD,T.TAVERNE,A.S. CASAGRANDE,L.DESIRE,
Literature Reference Citation MOLECULES,19,15411(2014)
Literature Reference DOI 10.3390/molecules191015411
Solvent DMSO-D6
Source File Reference UWLU81401