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4,5-DINITRO-2-(TRIFLUOROMETHYL)-IMIDAZOL_SODIUM_SALT
SpectraBase Compound ID IpRI8baSG14
InChI InChI=1S/C4F3N4O4.Na/c5-4(6,7)3-8-1(10(12)13)2(9-3)11(14)15;/q-1;+1
InChIKey ZQAZFSBVTWLCAU-UHFFFAOYSA-N
Mol Weight 248.05 g/mol
Molecular Formula C4F3N4NaO4
Exact Mass 247.976933 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID hY5R3LoZx8
Name 4,5-DINITRO-2-(TRIFLUOROMETHYL)-IMIDAZOL_SODIUM_SALT
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C4F3N4NaO4
InChI InChI=1S/C4F3N4O4.Na/c5-4(6,7)3-8-1(10(12)13)2(9-3)11(14)15;/q-1;+1
InChIKey ZQAZFSBVTWLCAU-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 248.053 g/mol
Sample ID 26315
Solvent ACETONE-D6