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5-(2-Chloro-4-trifluoromethyl-phenoxy)-2-nitro-benzoic acid

View entire compound with spectra: 4 NMR, 2 FTIR, and 1 MS (GC)

5-(2-Chloro-4-trifluoromethyl-phenoxy)-2-nitro-benzoic acid
SpectraBase Compound ID KhTRCvxBzWi
InChI InChI=1S/C14H7ClF3NO5/c15-10-5-7(14(16,17)18)1-4-12(10)24-8-2-3-11(19(22)23)9(6-8)13(20)21/h1-6H,(H,20,21)
InChIKey NUFNQYOELLVIPL-UHFFFAOYSA-N
Mol Weight 361.66 g/mol
Molecular Formula C14H7ClF3NO5
Exact Mass 360.996485 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3ppCww9D1oG
Name 5-(2-Chloro-4-trifluoromethyl-phenoxy)-2-nitro-benzoic acid
CAS Registry Number 50594-66-6
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C14H7ClF3NO5
InChI InChI=1S/C14H7ClF3NO5/c15-10-5-7(14(16,17)18)1-4-12(10)24-8-2-3-11(19(22)23)9(6-8)13(20)21/h1-6H,(H,20,21)
InChIKey NUFNQYOELLVIPL-UHFFFAOYSA-N
Instrument Name Bruker WM-360
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6