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Methyl 1,2-dihydro-4,6-dimethyl-3-nitro-2-[2'-(trifluoromethyl)phenyl]pyridine-5-carboxylate
SpectraBase Compound ID EiYAmf9OBww
InChI InChI=1S/C16H15F3N2O4/c1-8-12(15(22)25-3)9(2)20-13(14(8)21(23)24)10-6-4-5-7-11(10)16(17,18)19/h4-7,13,20H,1-3H3
InChIKey PQEIJLUQSUUWQL-UHFFFAOYSA-N
Mol Weight 356.3 g/mol
Molecular Formula C16H15F3N2O4
Exact Mass 356.098391 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9oXFSTs8tHo
Name Methyl 1,2-dihydro-4,6-dimethyl-3-nitro-2-[2'-(trifluoromethyl)phenyl]pyridine-5-carboxylate
Alternate Name(s) methyl 2,4-dimethyl-5-nitro-6-[2-(trifluoromethyl)phenyl]-1,6-dihydro-3-pyridinecarboxylate
Comments Less than 3 mono-isotopic peaks
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Formula C16H15F3N2O4
InChI InChI=1S/C16H15F3N2O4/c1-8-12(15(22)25-3)9(2)20-13(14(8)21(23)24)10-6-4-5-7-11(10)16(17,18)19/h4-7,13,20H,1-3H3
InChIKey PQEIJLUQSUUWQL-UHFFFAOYSA-N
Molecular Weight 356.301 g/mol
SMILES N1C(=C(C(=C(C1c1c(C(F)(F)F)cccc1)N(=O)=O)C)C(=O)OC)C
SPLASH splash10-03di-0092000000-80cc022c340db4956f2a
Source of Spectrum D8-324-794-12
Wiley ID 1514149