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4-Chlorobenzoic acid, phenyl ester
SpectraBase Compound ID 8j88TVzTxqd
InChI InChI=1S/C13H9ClO2/c14-11-8-6-10(7-9-11)13(15)16-12-4-2-1-3-5-12/h1-9H
InChIKey XXXJKBSLNRMHLH-UHFFFAOYSA-N
Mol Weight 232.67 g/mol
Molecular Formula C13H9ClO2
Exact Mass 232.029107 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8ZubENUAlQm
Name 4-Chlorobenzoic acid, phenyl ester
Alternate Name(s) Phenyl 4-Chlorobenzoate Phenyl 4-chloranylbenzoate
CAS Registry Number 1871-38-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H9ClO2
InChI InChI=1S/C13H9ClO2/c14-11-8-6-10(7-9-11)13(15)16-12-4-2-1-3-5-12/h1-9H
InChIKey XXXJKBSLNRMHLH-UHFFFAOYSA-N
Literature Reference DOI 10.1021/jo3012573
Molecular Weight 232.666 g/mol
SMILES c1c(ccc(c1)C(Oc1ccccc1)=O)Cl
SPLASH splash10-000i-0900000000-37b94a7bbec1dde2d3a4
Source of Spectrum J-77-8347-3ac
Wiley ID 1745225