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4,4,4-TRIFLUORO-1-(PARA-TOLYL)-BUTAN-1-ONE
SpectraBase Compound ID 74pxuEFjgmJ
InChI InChI=1S/C11H11F3O/c1-8-2-4-9(5-3-8)10(15)6-7-11(12,13)14/h2-5H,6-7H2,1H3
InChIKey VIVHSKGMXVQFTC-UHFFFAOYSA-N
Mol Weight 216.2 g/mol
Molecular Formula C11H11F3O
Exact Mass 216.076199 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7awCuXfchmc
Name 4,4,4-Trifluoro-1-(p-tolyl)butan-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H11F3O
InChI InChI=1S/C11H11F3O/c1-8-2-4-9(5-3-8)10(15)6-7-11(12,13)14/h2-5H,6-7H2,1H3
InChIKey VIVHSKGMXVQFTC-UHFFFAOYSA-N
Literature Reference DOI 10.1039/c3cc47879c
Molecular Weight 216.203 g/mol
SMILES c1cc(ccc1C)C(=O)CCC(F)(F)F
SPLASH splash10-014i-5900000000-b334bcd19242507ddde2
Source of Spectrum KD-50-1077/SMS11-2b
Synonyms 4,4,4-trifluoro-1-(4-methylphenyl)-1-butanone 4,4,4-trifluoro-1-(4-methylphenyl)butan-1-one 4,4,4-tris(fluoranyl)-1-(4-methylphenyl)butan-1-one
Wiley ID 1754269