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4,6-Dinitro-1-(2',4',6'-trinitrophenyl)benzimidazole

View entire compound with spectra: 2 NMR, and 1 MS (GC)

4,6-Dinitro-1-(2',4',6'-trinitrophenyl)benzimidazole
SpectraBase Compound ID AM05gwJziI5
InChI InChI=1S/C13H5N7O10/c21-16(22)6-1-8-12(9(2-6)18(25)26)14-5-15(8)13-10(19(27)28)3-7(17(23)24)4-11(13)20(29)30/h1-5H
InChIKey UKVAPBOCPDNWHG-UHFFFAOYSA-N
Mol Weight 419.22 g/mol
Molecular Formula C13H5N7O10
Exact Mass 419.009789 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DXAF28lyyRG
Name 1-PICRYL-4,6-DINITROBENZIMIDAZOLE
Compound Number 6A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H5N7O10
InChI InChI=1S/C13H5N7O10/c21-16(22)6-1-8-12(9(2-6)18(25)26)14-5-15(8)13-10(19(27)28)3-7(17(23)24)4-11(13)20(29)30/h1-5H
InChIKey UKVAPBOCPDNWHG-UHFFFAOYSA-N
Literature Reference Author A.J.FREYER,R.A.NISSAN,W.S.WILSON
Literature Reference Citation MAGN.RES.CHEM.,31,7(1993)
Literature Reference DOI 10.1002/mrc.1260310104
Molecular Weight 419.224 g/mol
Solvent DMSO-D6
Source File Reference UWMR158