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2,2,3,4,4-PENTACHLOR-3-BUTENSAEUREMETHYLESTER

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2,2,3,4,4-PENTACHLOR-3-BUTENSAEUREMETHYLESTER
SpectraBase Compound ID Cy38X4oQAy3
InChI InChI=1S/C5H3Cl5O2/c1-12-4(11)5(9,10)2(6)3(7)8/h1H3
InChIKey VGCYOYZZWOOTLW-UHFFFAOYSA-N
Mol Weight 272.3 g/mol
Molecular Formula C5H3Cl5O2
Exact Mass 269.857568 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID K2JstPX9gIi
Name PENTACHLORO-3-BUTENOIC ACID, METHYL ESTER
Source of Sample W. Kimpenhaus, W. Auf Der Heyde Liebigs Ann. Chem. 1983, 378
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C5H3Cl5O2
InChI InChI=1S/C5H3Cl5O2/c1-12-4(11)5(9,10)2(6)3(7)8/h1H3
InChIKey VGCYOYZZWOOTLW-UHFFFAOYSA-N
Molecular Weight 272.34
Solvent Dimethyl sulfoxide-d6; Reference=TMS; Temperature=Ambient Spectrometer= Bruker HX-90
Synonyms 3-BUTENOIC ACID, PENTACHLORO-, METHYL ESTER