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Chloroacetic acid, 4-biphenyl ester

View entire compound with spectra: 1 NMR, and 1 FTIR

Chloroacetic acid, 4-biphenyl ester
SpectraBase Compound ID GVzhKOrzrDr
InChI InChI=1S/C14H11ClO2/c15-10-14(16)17-13-8-6-12(7-9-13)11-4-2-1-3-5-11/h1-9H,10H2
InChIKey WUUVYGBVFQJTLM-UHFFFAOYSA-N
Mol Weight 246.69 g/mol
Molecular Formula C14H11ClO2
Exact Mass 246.044757 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID B7ronnMRVgT
Name Chloroacetic acid, 4-biphenyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 246.044757292 u
Formula C14H11ClO2
InChI InChI=1S/C14H11ClO2/c15-10-14(16)17-13-8-6-12(7-9-13)11-4-2-1-3-5-11/h1-9H,10H2
InChIKey WUUVYGBVFQJTLM-UHFFFAOYSA-N
Molecular Weight 246.693 g/mol
SMILES C(C(=O)OC1=CC=C(C2=CC=CC=C2)C=C1)Cl
Spectrum/Structure Validation Score (Vapor Phase IR) 0.877422