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2-Chloro-benzoic acid, methyl ester

View entire compound with spectra: 27 NMR, 3 FTIR, and 5 MS (GC)

2-Chloro-benzoic acid, methyl ester
SpectraBase Compound ID 5YVfPGIT1dg
InChI InChI=1S/C8H7ClO2/c1-11-8(10)6-4-2-3-5-7(6)9/h2-5H,1H3
InChIKey JAVRNIFMYIJXIE-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 LeQhppBjCT1
Name Benzoic acid, 2-chloro-, methyl ester
Alternate Name(s) 2-Chlorobenzoic acid methyl ester 6-Chlorobenzoic acid, methyl ester Benzoic acid, o-chloro-, methyl ester Methyl 2-chloranylbenzoate Methyl 2-chlorobenzoate Methyl o-chlorobenzoate AI3-23031 EINECS 210-242-0 NSC 7320
CAS Registry Number 610-96-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H7ClO2
InChI InChI=1S/C8H7ClO2/c1-11-8(10)6-4-2-3-5-7(6)9/h2-5H,1H3
InChIKey JAVRNIFMYIJXIE-UHFFFAOYSA-N
Molecular Weight 170.595 g/mol
SMILES c1(C(=O)OC)c(Cl)cccc1
SPLASH splash10-01p9-1900000000-1431a9848963a73d7e6d
Source of Spectrum AD-0-2532-0
Wiley ID 1426847