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Chloroacetic acid methyl ester
SpectraBase Compound ID AStc2wnsoHw
InChI InChI=1S/C3H5ClO2/c1-6-3(5)2-4/h2H2,1H3
InChIKey QABLOFMHHSOFRJ-UHFFFAOYSA-N
Mol Weight 108.52 g/mol
Molecular Formula C3H5ClO2
Exact Mass 107.997807 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AXecQFtKuSw
Name Methyl chloroacetate
Source of Sample Sigma-Aldrich Cat. #36546
CAS Registry Number 96-34-4
Classification Pesticides: Herbicides
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 107.997807099 u
Formula C3H5ClO2
InChI InChI=1S/C3H5ClO2/c1-6-3(5)2-4/h2H2,1H3
InChIKey QABLOFMHHSOFRJ-UHFFFAOYSA-N
Molecular Weight 108.524 g/mol
Number of Peaks 41
RI1 750
SMILES C(Cl)C(=O)OC
SPLASH splash10-0a4i-9000000000-d0b6364d16ff0c98358e
Sample Comments RI1: measured on SLB-5ms (Alkanes) RI2: measured on Equity-1 (Alkanes)
Source of Spectrum Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy)
Synonyms Acetic acid, 2-chloro-, methyl ester
Wiley ID LM_PEST_496