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3-(Trifluoromethyl)toluene
SpectraBase Compound ID 2WjeEcyM92
InChI InChI=1S/C8H7F3/c1-6-3-2-4-7(5-6)8(9,10)11/h2-5H,1H3
InChIKey VJYXZJGDFJJDGF-UHFFFAOYSA-N
Mol Weight 160.14 g/mol
Molecular Formula C8H7F3
Exact Mass 160.049985 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DwQL96D8U6e
Name Benzene, 1-methyl-3-(trifluoromethyl)-
CAS Registry Number 401-79-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H7F3
InChI InChI=1S/C8H7F3/c1-6-3-2-4-7(5-6)8(9,10)11/h2-5H,1H3
InChIKey VJYXZJGDFJJDGF-UHFFFAOYSA-N
Molecular Weight 160.139 g/mol
SMILES C(c1cc(C)ccc1)(F)(F)F
SPLASH splash10-0006-9300000000-732d35a49e84887c7935
Source of Spectrum EP-2389-0-0
Synonyms 1-Methyl-3-(trifluoromethyl)benzene M-xylene, .alpha.,.alpha.,.alpha.-trifluoro-
Wiley ID 1156669