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4-Chloro-3,5-dinitrobenzotrifluoride

View entire compound with spectra: 10 NMR, 5 FTIR, 2 Raman, and 1 MS (GC)

4-Chloro-3,5-dinitrobenzotrifluoride
SpectraBase Compound ID HQdsbKnU5zx
InChI InChI=1S/C7H2ClF3N2O4/c8-6-4(12(14)15)1-3(7(9,10)11)2-5(6)13(16)17/h1-2H
InChIKey HFHAVERNVFNSHL-UHFFFAOYSA-N
Mol Weight 270.55 g/mol
Molecular Formula C7H2ClF3N2O4
Exact Mass 269.965519 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Ke9jkEbRlPJ
Name 4-Chloro-3,5-dinitrobenzotrifluoride
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 197017
CAS Registry Number 393-75-9
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H2ClF3N2O4
InChI InChI=1S/C7H2ClF3N2O4/c8-6-4(12(14)15)1-3(7(9,10)11)2-5(6)13(16)17/h1-2H
InChIKey HFHAVERNVFNSHL-UHFFFAOYSA-N
Observed nucleus 13C
Purity 99%
Solvent CDCl3
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms CDNT DNT-Cl
Wiley ID SIAL_13CNMR_002824