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4,5-DINITRO-2-(TRIFLUOROMETHYL)-IMIDAZOLE
SpectraBase Compound ID 81A7GAbvGMt
InChI InChI=1S/C4HF3N4O4/c5-4(6,7)3-8-1(10(12)13)2(9-3)11(14)15/h(H,8,9)
InChIKey RQZKQQNNVFRKFT-UHFFFAOYSA-N
Mol Weight 226.07 g/mol
Molecular Formula C4HF3N4O4
Exact Mass 225.994989 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5we3KhRIQZ9
Name 4,5-DINITRO-2-(TRIFLUOROMETHYL)-IMIDAZOLE
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C4HF3N4O4
InChI InChI=1S/C4HF3N4O4/c5-4(6,7)3-8-1(10(12)13)2(9-3)11(14)15/h(H,8,9)
InChIKey RQZKQQNNVFRKFT-UHFFFAOYSA-N
Literature Reference Author Y.HAYAKAWA,H.KIMOTO,L.A.COHEN,K.L.KIRK
Literature Reference Citation J.ORG.CHEM.,63,9448(1998)
Literature Reference DOI 10.1021/jo9814952
Molecular Weight 226.072 g/mol
Sample ID 26316
Solvent ACETONE-D6