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2-Fluoro-6-trifluoromethylbenzoic acid, 3,4-dichlorophenyl ester
SpectraBase Compound ID FyjrauUddzf
InChI InChI=1S/C14H6Cl2F4O2/c15-9-5-4-7(6-10(9)16)22-13(21)12-8(14(18,19)20)2-1-3-11(12)17/h1-6H
InChIKey RVNSBKSHHZXGMD-UHFFFAOYSA-N
Mol Weight 353.1 g/mol
Molecular Formula C14H6Cl2F4O2
Exact Mass 351.968097 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EeU4lJOArZO
Name 2-Fluoro-6-trifluoromethylbenzoic acid, 3,4-dichlorophenyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 351.968097483 u
Formula C14H6Cl2F4O2
InChI InChI=1S/C14H6Cl2F4O2/c15-9-5-4-7(6-10(9)16)22-13(21)12-8(14(18,19)20)2-1-3-11(12)17/h1-6H
InChIKey RVNSBKSHHZXGMD-UHFFFAOYSA-N
Molecular Weight 353.100 g/mol
SMILES C1(=C(C=C(C=C1)OC(C1=C(C(F)(F)F)C=CC=C1F)=O)Cl)Cl