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1-(4-Nitrophenyl)imidazole

View entire compound with spectra: 5 NMR, 1 FTIR, and 3 MS (GC)

1-(4-Nitrophenyl)imidazole
SpectraBase Compound ID CXEeY8L6kD1
InChI InChI=1S/C9H7N3O2/c13-12(14)9-3-1-8(2-4-9)11-6-5-10-7-11/h1-7H
InChIKey PUCOOPJLAXJKOO-UHFFFAOYSA-N
Mol Weight 189.17 g/mol
Molecular Formula C9H7N3O2
Exact Mass 189.053826 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Ki90s3aLuwG
Name 1-(4-Nitrophenyl)-1H-imidazole
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 444383
CAS Registry Number 2301-25-9
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H7N3O2
InChI InChI=1S/C9H7N3O2/c13-12(14)9-3-1-8(2-4-9)11-6-5-10-7-11/h1-7H
InChIKey PUCOOPJLAXJKOO-UHFFFAOYSA-N
Observed nucleus 13C
Purity 95%
Solvent DMSO-d6
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms (4-nitrophenyl)imidazole Imidazole, 1-(p-nitrophenyl)-
Wiley ID SIAL_13CNMR_009767