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3-Nitrobenzotrifluoride
SpectraBase Compound ID 4POoVdM8LGP
InChI InChI=1S/C7H4F3NO2/c8-7(9,10)5-2-1-3-6(4-5)11(12)13/h1-4H
InChIKey WHNAMGUAXHGCHH-UHFFFAOYSA-N
Mol Weight 191.11 g/mol
Molecular Formula C7H4F3NO2
Exact Mass 191.019413 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7zXeNY1J7wH
Name Benzene, 1-nitro-3-(trifluoromethyl)-
Alternate Name(s) .alpha.,.alpha.,.alpha.-Trifluoro-m-nitrotoluene 1,3-Nitrobenzotrifluoride 1-Nitro-3-(trifluoromethyl)benzene 3-(Trifluoromethyl)nitrobenzene 3-Nitro-.alpha.,.alpha.,.alpha.-trifluorotoluene 3-Nitrobenzotrifluoride m-(Trifluoromethyl)nitrobenzene m-Nitro-.alpha.,.alpha.,.alpha.-trifluorotoluene m-Nitrobenzotrifluoride m-Nitrotrifluorotoluene m-Nitrotrifluortoluol Toluene, .alpha.,.alpha.,.alpha.-trifluoro-m-nitro- USAF MA-5 AI3-07485 CCRIS 2814 EINECS 202-670-1 HSDB 4250 NSC 10313
CAS Registry Number 98-46-4
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Formula C7H4F3NO2
InChI InChI=1S/C7H4F3NO2/c8-7(9,10)5-2-1-3-6(4-5)11(12)13/h1-4H
InChIKey WHNAMGUAXHGCHH-UHFFFAOYSA-N
Molecular Weight 191.109 g/mol
SMILES C(F)(F)(F)c1cc(N(=O)=O)ccc1
SPLASH splash10-0002-4900000000-2cfb7962fd8fa67a5b1a
Source of Spectrum W6-14534-0-0
Wiley ID 131711