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1-[2-(2-METHYL-5-NITRO-IMIDAZOL-1-YL)-ETHYL]-PYRIDINIUM-CHLORIDE
SpectraBase Compound ID 994YMFhazR
InChI InChI=1S/C11H13N4O2.ClH/c1-10-12-9-11(15(16)17)14(10)8-7-13-5-3-2-4-6-13;/h2-6,9H,7-8H2,1H3;1H/q+1;/p-1
InChIKey QBZVRJMCTPUHCG-UHFFFAOYSA-M
Mol Weight 268.7 g/mol
Molecular Formula C11H13ClN4O2
Exact Mass 268.072703 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CScc1pd6Gar
Name 1-[2-(2-METHYL-5-NITRO-IMIDAZOL-1-YL)-ETHYL]-PYRIDINIUM-CHLORIDE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C11H13ClN4O2
InChI InChI=1S/C11H13N4O2.ClH/c1-10-12-9-11(15(16)17)14(10)8-7-13-5-3-2-4-6-13;/h2-6,9H,7-8H2,1H3;1H/q+1;/p-1
InChIKey QBZVRJMCTPUHCG-UHFFFAOYSA-M
Literature Reference Author E.ALCALDE,L.MANOS,N.VALLS,J.ELGUERO
Literature Reference Citation J.HETCYCL.CHEM.,21,1647(1984)
Literature Reference DOI 10.1002/jhet.5570210615
Molecular Weight 268.703 g/mol
Solvent DMSO-D6
Source File Reference UWED7726