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3-Bromo-4-methylbenzotrifluoride
SpectraBase Compound ID H8kd2sKMhL8
InChI InChI=1S/C8H6BrF3/c1-5-2-3-6(4-7(5)9)8(10,11)12/h2-4H,1H3
InChIKey TWWUWLMGYSLODU-UHFFFAOYSA-N
Mol Weight 239.04 g/mol
Molecular Formula C8H6BrF3
Exact Mass 237.960498 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Eueke5C7v9r
Name 3-Bromo-4-methylbenzotrifluoride
Alternate Name(s) 2-Bromanyl-1-methyl-4-(trifluoromethyl)benzene 2-Bromo-1-methyl-4-(trifluoromethyl)benzene
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Formula C8H6BrF3
InChI InChI=1S/C8H6BrF3/c1-5-2-3-6(4-7(5)9)8(10,11)12/h2-4H,1H3
InChIKey TWWUWLMGYSLODU-UHFFFAOYSA-N
Molecular Weight 239.035 g/mol
SMILES C(c1cc(Br)c(cc1)C)(F)(F)F
SPLASH splash10-0a4i-0960000000-a946d9355a3ab69eb082
Source of Spectrum C-115-3124-14
Wiley ID 1239929