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3,3,3-trichloropropionic acid, methyl ester

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3,3,3-trichloropropionic acid, methyl ester
SpectraBase Compound ID 5p4zAQ9euiH
InChI InChI=1S/C4H5Cl3O2/c1-9-3(8)2-4(5,6)7/h2H2,1H3
InChIKey FBMIRDYZKMXRFO-UHFFFAOYSA-N
Mol Weight 191.44 g/mol
Molecular Formula C4H5Cl3O2
Exact Mass 189.935512 g/mol

17O Nuclear Magnetic Resonance (NMR) Chemical Shifts

17O Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KNj0ZjxCg8G
Name METHYL-3,3,3-TRICHLOROPROPANATE
Compound Number 9
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C4H5Cl3O2
InChI InChI=1S/C4H5Cl3O2/c1-9-3(8)2-4(5,6)7/h2H2,1H3
InChIKey FBMIRDYZKMXRFO-UHFFFAOYSA-N
Literature Reference Author E.KOLEHMAINEN,I.O.O.KORHONEN,R.KAUPPINEN
Literature Reference Citation MAGN.RES.CHEM.,32,186(1994)
Literature Reference DOI 10.1002/mrc.1260320311
Solvent CDCl3
Source File Reference UWCP1175