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3,4-DINITROBENZOTRIFLUORIDE
SpectraBase Compound ID AnXpzct5135
InChI InChI=1S/C7H3F3N2O4/c8-7(9,10)4-1-2-5(11(13)14)6(3-4)12(15)16/h1-3H
InChIKey YHJKXNJDFDLMGU-UHFFFAOYSA-N
Mol Weight 236.11 g/mol
Molecular Formula C7H3F3N2O4
Exact Mass 236.004491 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DkZxQtlcrEJ
Name 3,4-DINITROBENZOTRIFLUORIDE
Comments EXTERNAL STANDARD-CFCL3 OR C6F6 (-162.9 FROM CFCL3). `+` AXIS-LOW
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C7H3F3N2O4
InChI InChI=1S/C7H3F3N2O4/c8-7(9,10)4-1-2-5(11(13)14)6(3-4)12(15)16/h1-3H
InChIKey YHJKXNJDFDLMGU-UHFFFAOYSA-N
Instrument Name Bruker WP-80
Literature Reference JAMES H. CLARK, JAMES E. DENNESS, MARTIN A. MCCLINTON, ANDREW J. WYND (1990)J.Fluor.Chem.: v.50, N3, 411-426.
NMR Standard CCl3F
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent reaction mixture