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Chlorobenzoic acid, methyl ester
SpectraBase Compound ID 972nIIBb2xe
InChI InChI=1S/C8H7ClO2/c1-11-8(10)6-2-4-7(9)5-3-6/h2-5H,1H3
InChIKey LXNFVVDCCWUUKC-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 5GDPsAF5YI2
Name Benzoic acid, 4-chloro-, methyl ester
Alternate Name(s) 4-Chlorobenzoic acid methyl ester Benzoic acid, p-chloro-, methyl ester Methyl 4-chloranylbenzoate Methyl 4-chlorobenzoate Methyl ester of p-chlorobenzoic acid Methyl p-chlorobenzoate AI3-23578 EINECS 214-420-9 NSC 8366
CAS Registry Number 1126-46-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H7ClO2
InChI InChI=1S/C8H7ClO2/c1-11-8(10)6-2-4-7(9)5-3-6/h2-5H,1H3
InChIKey LXNFVVDCCWUUKC-UHFFFAOYSA-N
Molecular Weight 170.595 g/mol
SMILES COC(=O)c1ccc(Cl)cc1
SPLASH splash10-022l-2900000000-1baa6a3f1424ca464111
Source of Spectrum UB-0-34-0
Wiley ID 1166231