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4-Nitroimidazole

View entire compound with spectra: 15 NMR, 6 FTIR, 2 Raman, 2 UV-Vis, and 3 MS (GC)

4-Nitroimidazole
SpectraBase Compound ID 6iIovu3jDx8
InChI InChI=1S/C3H3N3O2/c7-6(8)3-1-4-2-5-3/h1-2H,(H,4,5)
InChIKey VYDWQPKRHOGLPA-UHFFFAOYSA-N
Mol Weight 113.076 g/mol
Molecular Formula C3H3N3O2
Exact Mass 113.022526 g/mol

15N Nuclear Magnetic Resonance (NMR) Chemical Shifts

15N Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8SGyzVaTmnh
Name 4(5)-NITROIMIDAZOLE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C3H3N3O2
InChI InChI=1S/C3H3N3O2/c7-6(8)3-1-4-2-5-3/h1-2H,(H,4,5)
InChIKey VYDWQPKRHOGLPA-UHFFFAOYSA-N
Literature Reference Author B.C.CHEN,W.VONPHILIPSBORN,K.NAGARAJAN
Literature Reference Citation HELV.CHIM.ACTA,66,1537(1983)
Literature Reference DOI 10.1002/hlca.19830660522
Solvent DMSO-D6:ACETONE=3:1
Source File Reference UWRH294