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4,4-DIFLUORO-1-(4-METHYLPHENYL)-3-(TRIFLUOROMETHYL)-BUT-3-EN-1-ONE
SpectraBase Compound ID GfXEIYmqXIE
InChI InChI=1S/C12H9F5O/c1-7-2-4-8(5-3-7)10(18)6-9(11(13)14)12(15,16)17/h2-5H,6H2,1H3
InChIKey WCATYSGYBJRJDR-UHFFFAOYSA-N
Mol Weight 264.2 g/mol
Molecular Formula C12H9F5O
Exact Mass 264.057356 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID rAG8hvNcrI
Name 4,4-Difluoro-1-(p-tolyl)-3-(trifluoromethyl)but-3-en-1-one
Alternate Name(s) 4,4-Difluoro-1-(4-methylphenyl)-3-(trifluoromethyl)-3-buten-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H9F5O
InChI InChI=1S/C12H9F5O/c1-7-2-4-8(5-3-7)10(18)6-9(11(13)14)12(15,16)17/h2-5H,6H2,1H3
InChIKey WCATYSGYBJRJDR-UHFFFAOYSA-N
Molecular Weight 264.195 g/mol
SMILES C(CC(=C(F)F)C(F)(F)F)(=O)c1ccc(cc1)C
SPLASH splash10-0002-1290000000-f8d866d689d2165a2419
Source of Spectrum AH-138-231-6
Wiley ID 1612336