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Trichloro-acetic acid, ethyl ester
SpectraBase Compound ID HhdrakHyC0R
InChI InChI=1S/C4H5Cl3O2/c1-2-9-3(8)4(5,6)7/h2H2,1H3
InChIKey SJMLNDPIJZBEKY-UHFFFAOYSA-N
Mol Weight 191.44 g/mol
Molecular Formula C4H5Cl3O2
Exact Mass 189.935512 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1txNa4gh6b
Name Acetic acid, trichloro-, ethyl ester
Alternate Name(s) 2,2,2-trichloroacetic acid ethyl ester Acetic acid, 2,2,2-trichloroethyl ester Acetic acid, ester with trichloroethanol Ethyl 2,2,2-trichloroacetate Ethyl 2,2,2-tris(chloranyl)ethanoate Ethyl trichloroacetate Trichloroethyl acetate AI3-28577 EINECS 208-212-7 NSC 8829
CAS Registry Number 515-84-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C4H5Cl3O2
InChI InChI=1S/C4H5Cl3O2/c1-2-9-3(8)4(5,6)7/h2H2,1H3
InChIKey SJMLNDPIJZBEKY-UHFFFAOYSA-N
Molecular Weight 191.441 g/mol
SMILES C(Cl)(C(=O)OCC)(Cl)Cl
SPLASH splash10-004i-9300000000-5a0ef3cea175f58b1dac
Source of Spectrum AA-0-1317-3
Wiley ID 20563