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(4-Chlorophenyl)acetic acid
SpectraBase Compound ID 6cUPMEqTXTq
InChI InChI=1S/C8H7ClO2/c9-7-3-1-6(2-4-7)5-8(10)11/h1-4H,5H2,(H,10,11)
InChIKey CDPKJZJVTHSESZ-UHFFFAOYSA-N
Mol Weight 170.59 g/mol
Molecular Formula C8H7ClO2
Exact Mass 170.013457 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Kb4e5IWp7H9
Name Benzeneacetic acid, 4-chloro-
CAS Registry Number 1878-66-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H7ClO2
InChI InChI=1S/C8H7ClO2/c9-7-3-1-6(2-4-7)5-8(10)11/h1-4H,5H2,(H,10,11)
InChIKey CDPKJZJVTHSESZ-UHFFFAOYSA-N
Molecular Weight 170.595 g/mol
SMILES OC(=O)Cc1ccc(cc1)Cl
SPLASH splash10-00i3-2900000000-e67d88a34ca701b5dd5c
Source of Spectrum QB-14-620-0
Synonyms (4-Chlorophenyl)acetic acid (p-Chlorophenyl)acetic acid 2-(4-Chlorophenyl)acetic acid 2-(4-Chlorophenyl)ethanoic acid 2-(p-Chlorophenyl)acetic acid 4-Chlorobenzeneacetic acid Acetic acid, (p-chlorophenyl)- BRN 1072816 EINECS 217-521-6 NSC 14285
Wiley ID 841232