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2,2-DIMETHYL-5-NITRO-2-H-BENZIMIDAZOLE-1,3-DIOXIDE
SpectraBase Compound ID 7HnISVyH75e
InChI InChI=1S/C9H9N3O4/c1-9(2)10(13)7-4-3-6(12(15)16)5-8(7)11(9)14/h3-5H,1-2H3
InChIKey YLVSVJDCTDBERH-UHFFFAOYSA-N
Mol Weight 223.19 g/mol
Molecular Formula C9H9N3O4
Exact Mass 223.059306 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6FG0SZkYKa6
Name 2,2-DIMETHYL-5-NITRO-2-H-BENZIMIDAZOLE-1,3-DIOXIDE
Compound Number IV-A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H9N3O4
InChI InChI=1S/C9H9N3O4/c1-9(2)10(13)7-4-3-6(12(15)16)5-8(7)11(9)14/h3-5H,1-2H3
InChIKey YLVSVJDCTDBERH-UHFFFAOYSA-N
Literature Reference Author V.A.SAMSONOV,L.B.VOLODARSKII,O.V.SHAMIRZAEVA
Literature Reference Citation CHEM.HET.COMP.,30,460(1994)
Literature Reference DOI 10.1007/bf01169943
Molecular Weight 223.188 g/mol
Solvent CDCl3
Source File Reference UWMZ12835