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ethyl 3-(3-chloro-5-(trifluoromethyl)pyridin-2-yl)benzoate
SpectraBase Compound ID 3kFwCnlKa3v
InChI InChI=1S/C15H11ClF3NO2/c1-2-22-14(21)10-5-3-4-9(6-10)13-12(16)7-11(8-20-13)15(17,18)19/h3-8H,2H2,1H3
InChIKey NYTBALXJXLKEEI-UHFFFAOYSA-N
Mol Weight 329.71 g/mol
Molecular Formula C15H11ClF3NO2
Exact Mass 329.043041 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HPUEsxqQvYm
Name ethyl 3-(3-chloro-5-(trifluoromethyl)pyridin-2-yl)benzoate
Appearance Slightly yellow oil
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Exact Mass 329.043040785 u
Formula C15H11ClF3NO2
InChI InChI=1S/C15H11ClF3NO2/c1-2-22-14(21)10-5-3-4-9(6-10)13-12(16)7-11(8-20-13)15(17,18)19/h3-8H,2H2,1H3
InChIKey NYTBALXJXLKEEI-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/chem.201405275
Molecular Weight 329.706 g/mol
Reported Formula C15H11ClF3NO2
SMILES C(C)OC(C1=CC(=CC=C1)C1=NC=C(C=C1Cl)C(F)(F)F)=O
SPLASH splash10-001i-0094000000-8baeab7f0df12c784053
Source of Spectrum QE-21-SM20-3v (DOI: 10.1002/chem.201405275)
Wiley ID 1907429