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3,3,3-Trifluoro-1-o-tolylpropan-1-one
SpectraBase Compound ID Ct2dRbbODHQ
InChI InChI=1S/C10H9F3O/c1-7-4-2-3-5-8(7)9(14)6-10(11,12)13/h2-5H,6H2,1H3
InChIKey QDEXBDAKFALNKG-UHFFFAOYSA-N
Mol Weight 202.18 g/mol
Molecular Formula C10H9F3O
Exact Mass 202.060549 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 65j5eUjf3oV
Name 3,3,3-Trifluoro-1-o-tolylpropan-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H9F3O
InChI InChI=1S/C10H9F3O/c1-7-4-2-3-5-8(7)9(14)6-10(11,12)13/h2-5H,6H2,1H3
InChIKey QDEXBDAKFALNKG-UHFFFAOYSA-N
Literature Reference DOI 10.1016/j.jfluchem.2014.01.020
Molecular Weight 202.176 g/mol
SMILES c1c(c(C(CC(F)(F)F)=O)ccc1)C
SPLASH splash10-014l-8930000000-48f11292829514a55014
Source of Spectrum JFC-161-132-2f
Synonyms 3,3,3-trifluoro-1-(o-tolyl)propan-1-one 3,3,3-trifluoro-1-(2-methylphenyl)-1-propanone 3,3,3-trifluoro-1-(2-methylphenyl)propan-1-one 3,3,3-tris(fluoranyl)-1-(2-methylphenyl)propan-1-one
Wiley ID 1746500