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3-Nitro-5-(trifluoromethyl)benzoic acid
SpectraBase Compound ID Drvil2R6fRz
InChI InChI=1S/C8H4F3NO4/c9-8(10,11)5-1-4(7(13)14)2-6(3-5)12(15)16/h1-3H,(H,13,14)
InChIKey ODCLHXGXGFBBTA-UHFFFAOYSA-N
Mol Weight 235.12 g/mol
Molecular Formula C8H4F3NO4
Exact Mass 235.009242 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1tMVcqvGSmJ
Name 5-nitro-alpha,alpha,alpha-trifluoro-m-toluic acid
Source of Sample Pierce Chemical Company, Rockford, Illinois
Copyright Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H4F3NO4
InChI InChI=1S/C8H4F3NO4/c9-8(10,11)5-1-4(7(13)14)2-6(3-5)12(15)16/h1-3H,(H,13,14)
InChIKey ODCLHXGXGFBBTA-UHFFFAOYSA-N
Instrument Name Varian A-60
Sadtler NMR Number 900M
Solvent CDCl3
Synonyms M-TOLUIC ACID, 5-NITRO-A,A,A-TRI- FLUORO-,