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4-Methylbenzotrifluoride
SpectraBase Compound ID 4F6xsDpY8li
InChI InChI=1S/C8H7F3/c1-6-2-4-7(5-3-6)8(9,10)11/h2-5H,1H3
InChIKey LRLRAYMYEXQKID-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 DxAlZfcltwP
Name Benzene, 1-methyl-4-(trifluoromethyl)-
Alternate Name(s) p-Xylene, .alpha.,.alpha.,.alpha.-trifluoro- 1-Methyl-4-(trifluoromethyl)benzene 4-(Trifluoromethyl)toluene 4-Methylbenzotrifluoride EINECS 228-124-2
CAS Registry Number 6140-17-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H7F3
InChI InChI=1S/C8H7F3/c1-6-2-4-7(5-3-6)8(9,10)11/h2-5H,1H3
InChIKey LRLRAYMYEXQKID-UHFFFAOYSA-N
Molecular Weight 160.139 g/mol
SMILES c1cc(ccc1C)C(F)(F)F
SPLASH splash10-01ox-9600000000-f519ed1ffdd11a0ada11
Source of Spectrum EP-2383-0-0
Wiley ID 1156670