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2-Chloro-5-nitro-alpha,alpha,alpha-trifluorotoluene
SpectraBase Compound ID EFH282ilqgD
InChI InChI=1S/C7H3ClF3NO2/c8-6-2-1-4(12(13)14)3-5(6)7(9,10)11/h1-3H
InChIKey HQROXDLWVGFPDE-UHFFFAOYSA-N
Mol Weight 225.55 g/mol
Molecular Formula C7H3ClF3NO2
Exact Mass 224.980441 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ArVF2ZWHUWX
Name 1-Chloro-4-nitro-2-(trifluoromethyl)benzene
Alternate Name(s) 1-Chloranyl-4-nitro-2-(trifluoromethyl)benzene 2-(Trifluoromethyl)-4-nitrochlorobenzene 2-Chloro-.alpha.,.alpha.,.alpha.-trifluoro-5-nitrotoluene 2-Chloro-5-nitrobenzotrifluoride 3-(Trifluoromethyl)-4-chloronitrobenzene 4-Chloro-3-(trifluoromethyl)nitrobenzene 4-Nitro-2-(trifluoromethyl)chlorobenzene Benzene, 1-chloro-4-nitro-2-(trifluoromethyl)- Toluene, 2-chloro-.alpha.,.alpha.,.alpha.-trifluoro-5-nitro- AI3-28914 EINECS 212-287-1 NSC 9467
CAS Registry Number 777-37-7
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Formula C7H3ClF3NO2
InChI InChI=1S/C7H3ClF3NO2/c8-6-2-1-4(12(13)14)3-5(6)7(9,10)11/h1-3H
InChIKey HQROXDLWVGFPDE-UHFFFAOYSA-N
Molecular Weight 225.554 g/mol
SMILES C(F)(F)(F)c1cc(N(=O)=O)ccc1Cl
SPLASH splash10-004i-4920000000-57d0e071aeb0a0800dd2
Source of Spectrum W6-19734-0-0
Wiley ID 97175