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(E)-4-ethoxy-1,1,1-trifluoro-4-(2-hydroxyethylamino)-3-buten-2-one
SpectraBase Compound ID TG1suvAeC6
InChI InChI=1S/C8H12F3NO3/c1-2-15-7(12-3-4-13)5-6(14)8(9,10)11/h5,12-13H,2-4H2,1H3/b7-5+
InChIKey MNWUJKUYDCRLBZ-FNORWQNLSA-N
Mol Weight 227.18 g/mol
Molecular Formula C8H12F3NO3
Exact Mass 227.076928 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DNqRgsUvZw7
Name (E)-4-ethoxy-1,1,1-trifluoro-4-(2-hydroxyethylamino)-3-buten-2-one
Alternate Name(s) (E)-4-ethoxy-1,1,1-trifluoro-4-(2-hydroxyethylamino)but-3-en-2-one (E)-4-ethoxy-1,1,1-tris(fluoranyl)-4-(2-hydroxyethylamino)but-3-en-2-one
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H12F3NO3
InChI InChI=1S/C8H12F3NO3/c1-2-15-7(12-3-4-13)5-6(14)8(9,10)11/h5,12-13H,2-4H2,1H3/b7-5+
InChIKey MNWUJKUYDCRLBZ-FNORWQNLSA-N
Molecular Weight 227.183 g/mol
SMILES N(\C(=C/C(C(F)(F)F)=O)OCC)CCO
SPLASH splash10-014i-9010000000-be7fab820adfa1835653
Source of Spectrum F4-0-1488-2
Wiley ID 1619627