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Dichloroacetic acid, hex-4-yn-3-yl ester
SpectraBase Compound ID DQLoqWwJchG
InChI InChI=1S/C8H10Cl2O2/c1-3-5-6(4-2)12-8(11)7(9)10/h6-7H,4H2,1-2H3
InChIKey HNJCYURZVMLJAK-UHFFFAOYSA-N
Mol Weight 209.07 g/mol
Molecular Formula C8H10Cl2O2
Exact Mass 208.005785 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3bV6MSrxT3w
Name Dichloroacetic acid, hex-4-yn-3-yl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H10Cl2O2
InChI InChI=1S/C8H10Cl2O2/c1-3-5-6(4-2)12-8(11)7(9)10/h6-7H,4H2,1-2H3
InChIKey HNJCYURZVMLJAK-UHFFFAOYSA-N
Molecular Weight 209.072 g/mol
SMILES C(C(=O)OC(CC)C#CC)(Cl)Cl
SPLASH splash10-003r-9100000000-cdf4dca1b9ed68be5096
Source of Spectrum NP-4-5395-0
Synonyms 2,2-Dichloroacetic acid hex-4-yn-3-yl ester Hex-4-yn-3-yl 2,2-dichloroacetate 1-Ethylbut-2-ynyl 2,2-dichloroacetate Hex-4-yn-3-yl 2,2-bis(chloranyl)ethanoate
Wiley ID 1104017