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1-(2,4,6-Trinitro-phenyl)-benzimidazole

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1-(2,4,6-Trinitro-phenyl)-benzimidazole
SpectraBase Compound ID EL52JHbH5MH
InChI InChI=1S/C13H7N5O6/c19-16(20)8-5-11(17(21)22)13(12(6-8)18(23)24)15-7-14-9-3-1-2-4-10(9)15/h1-7H
InChIKey RYPAKPZEWRUHNY-UHFFFAOYSA-N
Mol Weight 329.23 g/mol
Molecular Formula C13H7N5O6
Exact Mass 329.039633 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3he42oYbTY7
Name 1-(2,4,6-Trinitro-phenyl)-benzimidazole
CAS Registry Number 16778-58-8
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C13H7N5O6
InChI InChI=1S/C13H7N5O6/c19-16(20)8-5-11(17(21)22)13(12(6-8)18(23)24)15-7-14-9-3-1-2-4-10(9)15/h1-7H
InChIKey RYPAKPZEWRUHNY-UHFFFAOYSA-N
Instrument Name Jeol PS-100
Literature Reference M. Begtrup, J. Elguero, R. Faure, Magn. Res. Chem. 26, 134 (1988).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6