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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

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2J8KJa1QSCP
Name benzoic acid, 2-chloro-, methyl ester
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 170.013457163 u
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
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_1976
Solvent DMSO-d6
Source Vendor ID: NMR/12679658