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2,2-bis(Fluoranyl)-1-phenyl-propan-1-one
SpectraBase Compound ID H4vauVAFIaj
InChI InChI=1S/C9H8F2O/c1-9(10,11)8(12)7-5-3-2-4-6-7/h2-6H,1H3
InChIKey LBHQLBHEQJJNQL-UHFFFAOYSA-N
Mol Weight 170.16 g/mol
Molecular Formula C9H8F2O
Exact Mass 170.054321 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8qcCWBHxBo6
Name 2,2-bis(Fluoranyl)-1-phenyl-propan-1-one
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 170.054321203 u
Formula C9H8F2O
InChI InChI=1S/C9H8F2O/c1-9(10,11)8(12)7-5-3-2-4-6-7/h2-6H,1H3
InChIKey LBHQLBHEQJJNQL-UHFFFAOYSA-N
Molecular Weight 170.159 g/mol
SMILES C(C(=O)C=1C=CC=CC1)(F)(F)C