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.alpha.-[p-Chlorophenyl]succinic acid

View entire compound with spectra: 1 FTIR

.alpha.-[p-Chlorophenyl]succinic acid
SpectraBase Compound ID 7TwdUU8Fpjp
InChI InChI=1S/C10H9ClO4/c11-7-3-1-6(2-4-7)8(10(14)15)5-9(12)13/h1-4,8H,5H2,(H,12,13)(H,14,15)
InChIKey AGFXJIDIVHRKCA-UHFFFAOYSA-N
Mol Weight 228.63 g/mol
Molecular Formula C10H9ClO4
Exact Mass 228.018936 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 6R8eJP5w6I7
Name .alpha.-[p-Chlorophenyl]succinic acid
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 228.018936466 u
Formula C10H9ClO4
InChI InChI=1S/C10H9ClO4/c11-7-3-1-6(2-4-7)8(10(14)15)5-9(12)13/h1-4,8H,5H2,(H,12,13)(H,14,15)
InChIKey AGFXJIDIVHRKCA-UHFFFAOYSA-N
Molecular Weight 228.631 g/mol
SMILES C(O)(=O)CC(C(O)=O)C1=CC=C(Cl)C=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.962547