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2,2,3,4,4-PENTACHLOR-3-BUTENSAEURE
SpectraBase Compound ID J6vRvJsoo9c
InChI InChI=1S/C4HCl5O2/c5-1(2(6)7)4(8,9)3(10)11/h(H,10,11)
InChIKey CKGWGTNKIWPBKE-UHFFFAOYSA-N
Mol Weight 258.3 g/mol
Molecular Formula C4HCl5O2
Exact Mass 255.841918 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7WgvKx1Lsue
Name 2,2,3,4,4-PENTACHLORO-3-BUTENOIC ACID
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 C4HCl5O2
InChI InChI=1S/C4HCl5O2/c5-1(2(6)7)4(8,9)3(10)11/h(H,10,11)
InChIKey CKGWGTNKIWPBKE-UHFFFAOYSA-N
Molecular Weight 258.32
Solvent Dimethyl sulfoxide-d6; Reference=TMS; Temperature=Ambient Spectrometer= Bruker HX-90
Synonyms 3-BUTENOIC ACID, 2,2,3,4,4-PENTACHLORO-,