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3-(2,2,2-Trifluoroethyl)toluene

View entire compound with spectra: 1 MS (GC)

3-(2,2,2-Trifluoroethyl)toluene
SpectraBase Compound ID 5Q0FXEbuuH1
InChI InChI=1S/C9H9F3/c1-7-3-2-4-8(5-7)6-9(10,11)12/h2-5H,6H2,1H3
InChIKey TVCBUCYMSTYMTO-UHFFFAOYSA-N
Mol Weight 174.17 g/mol
Molecular Formula C9H9F3
Exact Mass 174.065635 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID k8K01Srsb6
Name 3-(2,2,2-Trifluoroethyl)toluene
Alternate Name(s) 1-Methyl-3-(2,2,2-trifluoroethyl)benzene 1-Methyl-3-[2,2,2-tris(fluoranyl)ethyl]benzene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H9F3
InChI InChI=1S/C9H9F3/c1-7-3-2-4-8(5-7)6-9(10,11)12/h2-5H,6H2,1H3
InChIKey TVCBUCYMSTYMTO-UHFFFAOYSA-N
Molecular Weight 174.166 g/mol
SMILES c1(cc(ccc1)CC(F)(F)F)C
SPLASH splash10-0a4i-0900000000-d8d445de22686f76c9a7
Source of Spectrum KC-0-729-4
Wiley ID 780784