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Methyl 2-(trifluoromethyl)isonicotinate
SpectraBase Compound ID 2ZaRfnxzN5P
InChI InChI=1S/C8H6F3NO2/c1-14-7(13)5-2-3-12-6(4-5)8(9,10)11/h2-4H,1H3
InChIKey XQCJUIRPIWHLLS-UHFFFAOYSA-N
Mol Weight 205.14 g/mol
Molecular Formula C8H6F3NO2
Exact Mass 205.035063 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7fQbvfVOlGH
Name Methyl 2-(trifluoromethyl)isonicotinate
Alternate Name(s) 2-(trifluoromethyl)-4-pyridinecarboxylic acid methyl ester Methyl 2-(trifluoromethyl)pyridine-4-carboxylate
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Formula C8H6F3NO2
InChI InChI=1S/C8H6F3NO2/c1-14-7(13)5-2-3-12-6(4-5)8(9,10)11/h2-4H,1H3
InChIKey XQCJUIRPIWHLLS-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol501967c
Molecular Weight 205.136 g/mol
SMILES c1c(C(OC)=O)cc(nc1)C(F)(F)F
SPLASH splash10-05fs-1930000000-24bb66b22de9cb696f4c
Source of Spectrum A1-16-4268/SMS26-4f
Wiley ID 1751139