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4-(3-fluoro-6-methoxyquinolin-4-yl)butan-2-one
SpectraBase Compound ID 5BB0XOzOQAx
InChI InChI=1S/C14H14FNO2/c1-9(17)3-5-11-12-7-10(18-2)4-6-14(12)16-8-13(11)15/h4,6-8H,3,5H2,1-2H3
InChIKey IPAFKHXQLDBARH-UHFFFAOYSA-N
Mol Weight 247.27 g/mol
Molecular Formula C14H14FNO2
Exact Mass 247.100857 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4lP4rEj5MeZ
Name 4-(3-fluoro-6-methoxyquinolin-4-yl)butan-2-one
Appearance Colorless solid
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Formula C14H14FNO2
InChI InChI=1S/C14H14FNO2/c1-9(17)3-5-11-12-7-10(18-2)4-6-14(12)16-8-13(11)15/h4,6-8H,3,5H2,1-2H3
InChIKey IPAFKHXQLDBARH-UHFFFAOYSA-N
Instrument Name Agilent Technologies 7890A & Agilent Technologies 5975C Inert XL EI/CI MSD
Ionization Type EI
Literature Reference DOI 10.1002/anie.201906898
Molecular Weight 247.269 g/mol
Reported Formula C14H14FNO2
SMILES c1(F)cnc2c(c1CCC(C)=O)cc(cc2)OC
SPLASH splash10-0f6w-0590000000-6ba63f8a9b51cd3a43d1
Source of Spectrum ACI-58-SM35-7m
Wiley ID 1875538