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2-(4-Chlorophenyl)-1-(3-fluorophenyl)ethanone
SpectraBase Compound ID BG5Onoe45Wk
InChI InChI=1S/C14H10ClFO/c15-12-6-4-10(5-7-12)8-14(17)11-2-1-3-13(16)9-11/h1-7,9H,8H2
InChIKey NFEVNNXCPNMBNP-UHFFFAOYSA-N
Mol Weight 248.68 g/mol
Molecular Formula C14H10ClFO
Exact Mass 248.040421 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID Xitj7OBJIJ
Name 2-(4-Chlorophenyl)-1-(3-fluorophenyl)ethanone
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 248.040420804 u
Formula C14H10ClFO
InChI InChI=1S/C14H10ClFO/c15-12-6-4-10(5-7-12)8-14(17)11-2-1-3-13(16)9-11/h1-7,9H,8H2
InChIKey NFEVNNXCPNMBNP-UHFFFAOYSA-N
Molecular Weight 248.684 g/mol
SMILES C(CC1=CC=C(C=C1)Cl)(=O)C1=CC(=CC=C1)F
Spectrum/Structure Validation Score (Vapor Phase IR) 0.927443