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5-[p-Chlorophenyl]sorbic acid

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

5-[p-Chlorophenyl]sorbic acid
SpectraBase Compound ID GteTn9JFC3X
InChI InChI=1S/C12H11ClO2/c1-9(3-2-4-12(14)15)10-5-7-11(13)8-6-10/h2-8H,1H3,(H,14,15)/b4-2+,9-3+
InChIKey DUNNXJVNDJETSJ-QIAUARBPSA-N
Mol Weight 222.67 g/mol
Molecular Formula C12H11ClO2
Exact Mass 222.044757 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID AJ5ZtT4LzWz
Name 5-[p-Chlorophenyl]sorbic acid
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 222.044757292 u
Formula C12H11ClO2
InChI InChI=1S/C12H11ClO2/c1-9(3-2-4-12(14)15)10-5-7-11(13)8-6-10/h2-8H,1H3,(H,14,15)/b4-2+,9-3+
InChIKey DUNNXJVNDJETSJ-QIAUARBPSA-N
Molecular Weight 222.671 g/mol
SMILES C(\C=C\C=C\(C1=CC=C(C=C1)Cl)C)(=O)O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.835704