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5-p-Nitrophenyl-1-(2,2,2-Trifluoroethyl)tetrazole
SpectraBase Compound ID Bu179gMVePO
InChI InChI=1S/C9H6F3N5O2/c10-9(11,12)5-16-8(13-14-15-16)6-1-3-7(4-2-6)17(18)19/h1-4H,5H2
InChIKey SKCWNTVLZWMKRK-UHFFFAOYSA-N
Mol Weight 273.18 g/mol
Molecular Formula C9H6F3N5O2
Exact Mass 273.047359 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1efWlVN8eW2
Name 5-p-Nitrophenyl-1-(2,2,2-Trifluoroethyl)tetrazole
Alternate Name(s) 5-(4-nitrophenyl)-1-(2,2,2-trifluoroethyl)-1H-tetraazole 5-(4-nitrophenyl)-1-[2,2,2-tris(fluoranyl)ethyl]-1,2,3,4-tetrazole
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Formula C9H6F3N5O2
InChI InChI=1S/C9H6F3N5O2/c10-9(11,12)5-16-8(13-14-15-16)6-1-3-7(4-2-6)17(18)19/h1-4H,5H2
InChIKey SKCWNTVLZWMKRK-UHFFFAOYSA-N
Molecular Weight 273.175 g/mol
SMILES c1([n](nnn1)CC(F)(F)F)-c1ccc(N(=O)=O)cc1
SPLASH splash10-0089-9040000000-d0db6213fe8c28e4e362
Source of Spectrum K-2002-1333-9
Wiley ID 1581477