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4,4,4-Triflulro-3-hydroxy-3-methyl-1-(4-methylphenyl)butan-1-one
SpectraBase Compound ID 4mBtLr6NkYN
InChI InChI=1S/C12H13F3O2/c1-8-3-5-9(6-4-8)10(16)7-11(2,17)12(13,14)15/h3-6,17H,7H2,1-2H3
InChIKey WKXCEBOWMRROJM-UHFFFAOYSA-N
Mol Weight 246.23 g/mol
Molecular Formula C12H13F3O2
Exact Mass 246.086764 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8WTMDxSBYTR
Name 4,4,4-Triflulro-3-hydroxy-3-methyl-1-(4-methylphenyl)butan-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H13F3O2
InChI InChI=1S/C12H13F3O2/c1-8-3-5-9(6-4-8)10(16)7-11(2,17)12(13,14)15/h3-6,17H,7H2,1-2H3
InChIKey WKXCEBOWMRROJM-UHFFFAOYSA-N
Molecular Weight 246.229 g/mol
SMILES OC(C(F)(F)F)(CC(c1ccc(cc1)C)=O)C
SPLASH splash10-014l-9510000000-3e4364f991064aa55407
Source of Spectrum K-2001-2581-2
Synonyms 4,4,4-trifluoro-3-hydroxy-3-methyl-1-(4-methylphenyl)-1-butanone 4,4,4-trifluoro-3-hydroxy-3-methyl-1-(4-methylphenyl)butan-1-one 4,4,4-tris(fluoranyl)-3-methyl-1-(4-methylphenyl)-3-oxidanyl-butan-1-one
Wiley ID 1579810