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5/6-NITRO-1-METHYL-2-PYRIDIN-3-YL-1H-BENZIMIDAZOLE

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5/6-NITRO-1-METHYL-2-PYRIDIN-3-YL-1H-BENZIMIDAZOLE
SpectraBase Compound ID 9rLuaYw18fk
InChI InChI=1S/2C13H10N4O2/c1-16-12-5-4-10(17(18)19)7-11(12)15-13(16)9-3-2-6-14-8-9;1-16-12-7-10(17(18)19)4-5-11(12)15-13(16)9-3-2-6-14-8-9/h2*2-8H,1H3
InChIKey HYCHOZPMDAJRSL-UHFFFAOYSA-N
Mol Weight 508.5 g/mol
Molecular Formula C26H20N8O4
Exact Mass 508.160751 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BPDPhpMQCWU
Name 5/6-NITRO-1-METHYL-2-PYRIDIN-3-YL-1H-BENZIMIDAZOLE
Compound Number 6ABD
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H20N8O4
InChI InChI=1S/2C13H10N4O2/c1-16-12-5-4-10(17(18)19)7-11(12)15-13(16)9-3-2-6-14-8-9;1-16-12-7-10(17(18)19)4-5-11(12)15-13(16)9-3-2-6-14-8-9/h2*2-8H,1H3
InChIKey HYCHOZPMDAJRSL-UHFFFAOYSA-N
Literature Reference Author M.H.JUNG,J.M.PARK,I.Y.C.LEE,M.AHN
Literature Reference Citation J.HETCYCL.CHEM.,40,37(2003)
Literature Reference DOI 10.1002/jhet.5570400104
Molecular Weight 508.496 g/mol
Solvent DMSO-D6
Source File Reference UWMS22303