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Methyl 5,7-dihydro-2-methyl-5-oxo-4-[2'-(trifluoromethyl)phenyl]-furo[3,4-b]pyridine-3-carboxylate
SpectraBase Compound ID ActznJwwOe4
InChI InChI=1S/C17H12F3NO4/c1-8-12(15(22)24-2)13(14-11(21-8)7-25-16(14)23)9-5-3-4-6-10(9)17(18,19)20/h3-6H,7H2,1-2H3
InChIKey ADZDESZRFCOFGD-UHFFFAOYSA-N
Mol Weight 351.28 g/mol
Molecular Formula C17H12F3NO4
Exact Mass 351.071842 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4PclSh945E7
Name Methyl 5,7-dihydro-2-methyl-5-oxo-4-[2'-(trifluoromethyl)phenyl]-furo[3,4-b]pyridine-3-carboxylate
Alternate Name(s) methyl 2-methyl-5-oxo-4-[2-(trifluoromethyl)phenyl]-5,7-dihydrofuro[3,4-b]pyridine-3-carboxylate
Comments Less than 3 mono-isotopic peaks
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Formula C17H12F3NO4
InChI InChI=1S/C17H12F3NO4/c1-8-12(15(22)24-2)13(14-11(21-8)7-25-16(14)23)9-5-3-4-6-10(9)17(18,19)20/h3-6H,7H2,1-2H3
InChIKey ADZDESZRFCOFGD-UHFFFAOYSA-N
Molecular Weight 351.281 g/mol
SMILES c1(c2c(COC2=O)nc(c1C(=O)OC)C)-c1c(C(F)(F)F)cccc1
SPLASH splash10-0f89-0009000000-bb9908a7c89ec2506ed8
Source of Spectrum D8-324-885-15
Wiley ID 1514208