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4'-Chloro-6-fluoro-3-methoxybiphenyl

View entire compound with spectra: 1 FTIR, and 1 MS (GC)

4'-Chloro-6-fluoro-3-methoxybiphenyl
SpectraBase Compound ID 9ToPIveHmEN
InChI InChI=1S/C13H10ClFO/c1-16-11-6-7-13(15)12(8-11)9-2-4-10(14)5-3-9/h2-8H,1H3
InChIKey VGAHJFAVWBXDTF-UHFFFAOYSA-N
Mol Weight 236.67 g/mol
Molecular Formula C13H10ClFO
Exact Mass 236.040421 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID ApcjSQjWk4p
Name 4'-Chloro-6-fluoro-3-methoxybiphenyl
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 236.040420804 u
Formula C13H10ClFO
InChI InChI=1S/C13H10ClFO/c1-16-11-6-7-13(15)12(8-11)9-2-4-10(14)5-3-9/h2-8H,1H3
InChIKey VGAHJFAVWBXDTF-UHFFFAOYSA-N
Molecular Weight 236.673 g/mol
SMILES C=1(C=CC(C=2C=C(C=CC2F)OC)=CC1)Cl
Spectrum/Structure Validation Score (Vapor Phase IR) 0.865474