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4'-Fluoro[1,1'-biphenyl]-4-carboxylic acid
SpectraBase Compound ID G1SsUiGeG9C
InChI InChI=1S/C13H9FO2/c14-12-7-5-10(6-8-12)9-1-3-11(4-2-9)13(15)16/h1-8H,(H,15,16)
InChIKey LXWNTLBMNCXRQN-UHFFFAOYSA-N
Mol Weight 216.21 g/mol
Molecular Formula C13H9FO2
Exact Mass 216.058658 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1wwZhTOfgrS
Name 4'-Fluoro[1,1'-biphenyl]-4-carboxylic acid
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 216.058657691 u
Formula C13H9FO2
InChI InChI=1S/C13H9FO2/c14-12-7-5-10(6-8-12)9-1-3-11(4-2-9)13(15)16/h1-8H,(H,15,16)
InChIKey LXWNTLBMNCXRQN-UHFFFAOYSA-N
Molecular Weight 216.211 g/mol
SMILES C1(F)=CC=C(C=C1)C1=CC=C(C=C1)C(=O)O