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2-(2,2,2-Trifluoro-1-hydroxy-ethyl)malonic acid diethyl ester
SpectraBase Compound ID Brlbhh1Ionz
InChI InChI=1S/C9H13F3O5/c1-3-16-7(14)5(8(15)17-4-2)6(13)9(10,11)12/h5-6,13H,3-4H2,1-2H3
InChIKey MJLGCAZDDADWAF-UHFFFAOYSA-N
Mol Weight 258.19 g/mol
Molecular Formula C9H13F3O5
Exact Mass 258.071508 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7J47Oy8tc0I
Name 2-(2,2,2-trifluoro-1-hydroxy-ethyl)malonic acid diethyl ester
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H13F3O5
InChI InChI=1S/C9H13F3O5/c1-3-16-7(14)5(8(15)17-4-2)6(13)9(10,11)12/h5-6,13H,3-4H2,1-2H3
InChIKey MJLGCAZDDADWAF-UHFFFAOYSA-N
Molecular Weight 258.193 g/mol
SMILES OC(C(F)(F)F)C(C(=O)OCC)C(=O)OCC
SPLASH splash10-02mr-1900000000-e22de0b52d0d16cc4040
Source of Spectrum F-70-9650-4
Synonyms 2-(2,2,2-trifluoro-1-hydroxyethyl)propanedioic acid diethyl ester Diethyl 2-(2,2,2-trifluoro-1-hydroxy-ethyl)propanedioate Diethyl 2-[2,2,2-tris(fluoranyl)-1-oxidanyl-ethyl]propanedioate
Wiley ID 1597855