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(3E)-1,1,1-trifluoro-3-[methylsulfonyl(phenyl)methylene]pentan-2-one
SpectraBase Compound ID gpbCbnrFwG
InChI InChI=1S/C13H13F3O3S/c1-3-10(12(17)13(14,15)16)11(20(2,18)19)9-7-5-4-6-8-9/h4-8H,3H2,1-2H3/b11-10+
InChIKey UOXCWIPPFYQWLY-ZHACJKMWSA-N
Mol Weight 306.3 g/mol
Molecular Formula C13H13F3O3S
Exact Mass 306.05375 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9zRcVSdOXwo
Name (3E)-1,1,1-trifluoro-3-[methylsulfonyl(phenyl)methylene]pentan-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H13F3O3S
InChI InChI=1S/C13H13F3O3S/c1-3-10(12(17)13(14,15)16)11(20(2,18)19)9-7-5-4-6-8-9/h4-8H,3H2,1-2H3/b11-10+
InChIKey UOXCWIPPFYQWLY-ZHACJKMWSA-N
Molecular Weight 306.299 g/mol
SMILES CS(\C(=C\(C(C(F)(F)F)=O)CC)c1ccccc1)(=O)=O
SPLASH splash10-00p0-1890000000-6875ef29c8a549eb84de
Source of Spectrum F-50-12413-12
Synonyms (3E)-1,1,1-trifluoro-3-[methylsulfonyl(phenyl)methylidene]-2-pentanone (3E)-1,1,1-trifluoro-3-[methylsulfonyl(phenyl)methylidene]pentan-2-one (3E)-1,1,1-tris(fluoranyl)-3-[methylsulfonyl(phenyl)methylidene]pentan-2-one (E)-3-ethyl-1,1,1-trifluoro-4-mesyl-4-phenyl-but-3-en-2-one
Wiley ID 789782