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3-AMINO-7-CHLORO-6-(TRIFLUOROMETHYL)-QUINOXALIN-2(1H)-ONE
SpectraBase Compound ID 5P5s5yOt8sM
InChI InChI=1S/C9H5ClF3N3O/c10-4-2-6-5(1-3(4)9(11,12)13)15-7(14)8(17)16-6/h1-2H,(H2,14,15)(H,16,17)
InChIKey VQNAXYMVHPCPDK-UHFFFAOYSA-N
Mol Weight 263.61 g/mol
Molecular Formula C9H5ClF3N3O
Exact Mass 263.007324 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BOwfa5N5r4a
Name 3-AMINO-7-CHLORO-6-(TRIFLUOROMETHYL)-QUINOXALIN-2(1H)-ONE
Compound Number 4B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H5ClF3N3O
InChI InChI=1S/C9H5ClF3N3O/c10-4-2-6-5(1-3(4)9(11,12)13)15-7(14)8(17)16-6/h1-2H,(H2,14,15)(H,16,17)
InChIKey VQNAXYMVHPCPDK-UHFFFAOYSA-N
Literature Reference Author E.CSIKOS,C.GOENCZI,B.PODANYI,G.TOTH,I.HERMECZ
Literature Reference Citation J.CHEM.SOC.PERKIN-1,1789(1999)
Literature Reference DOI 10.1039/a902978h
Molecular Weight 263.606 g/mol
Solvent DMSO-D6
Source File Reference UWGE3533