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3,4-Difluorobenzoic acid
SpectraBase Compound ID IC1BSGALsWX
InChI InChI=1S/C7H4F2O2/c8-5-2-1-4(7(10)11)3-6(5)9/h1-3H,(H,10,11)
InChIKey FPENCTDAQQQKNY-UHFFFAOYSA-N
Mol Weight 158.1 g/mol
Molecular Formula C7H4F2O2
Exact Mass 158.017936 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8ES5Bkmd1hY
Name 3,4-DIFLUOROBENZOIC ACID
Source of Sample Tokyo Kasei Kogyo Company, Ltd., Tokyo, Japan
CAS Registry Number 455-86-7
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H4F2O2
InChI InChI=1S/C7H4F2O2/c8-5-2-1-4(7(10)11)3-6(5)9/h1-3H,(H,10,11)
InChIKey FPENCTDAQQQKNY-UHFFFAOYSA-N
Melting Point 123C
Molecular Weight 158.11
Solvent Polysol; Reference=TMS Spectrometer= Bruker AC-300
Synonyms BENZOIC ACID, 3,4-DIFLUORO-,