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Benzenepentanoic acid, 4-chloro-; valeric acid, 5-(4-chlorophenyl)-

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

Benzenepentanoic acid, 4-chloro-; valeric acid, 5-(4-chlorophenyl)-
SpectraBase Compound ID AeDE2eIMvSc
InChI InChI=1S/C11H13ClO2/c12-10-7-5-9(6-8-10)3-1-2-4-11(13)14/h5-8H,1-4H2,(H,13,14)
InChIKey UYYNOIVMWZJAJV-UHFFFAOYSA-N
Mol Weight 212.68 g/mol
Molecular Formula C11H13ClO2
Exact Mass 212.060407 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID F2YC4iivp97
Name Benzenepentanoic acid, 4-chloro-; valeric acid, 5-(4-chlorophenyl)-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 212.060407357 u
Formula C11H13ClO2
InChI InChI=1S/C11H13ClO2/c12-10-7-5-9(6-8-10)3-1-2-4-11(13)14/h5-8H,1-4H2,(H,13,14)
InChIKey UYYNOIVMWZJAJV-UHFFFAOYSA-N
Molecular Weight 212.676 g/mol
SMILES OC(CCCCC1=CC=C(C=C1)Cl)=O
Spectrum/Structure Validation Score (Raman) 0.920913