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6-(4-fluorophenyl)-2-keto-4-[4-(2-methoxyphenyl)piperazino]pyran-3-carbonitrile
SpectraBase Compound ID B7nj7LAndlu
InChI InChI=1S/C23H20FN3O3/c1-29-21-5-3-2-4-19(21)26-10-12-27(13-11-26)20-14-22(30-23(28)18(20)15-25)16-6-8-17(24)9-7-16/h2-9,14H,10-13H2,1H3
InChIKey LLSNOGVXSLANBY-UHFFFAOYSA-N
Mol Weight 405.43 g/mol
Molecular Formula C23H20FN3O3
Exact Mass 405.14887 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4tXMm67OHfU
Name 6-(4-fluorophenyl)-2-keto-4-[4-(2-methoxyphenyl)piperazino]pyran-3-carbonitrile
Alternate Name(s) 6-(4-fluorophenyl)-4-[4-(2-methoxyphenyl)-1-piperazinyl]-2-oxo-3-pyrancarbonitrile 6-(4-fluorophenyl)-4-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxidanylidene-pyran-3-carbonitrile 6-(4-fluorophenyl)-4-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxo-pyran-3-carbonitrile
Comments Less than 3 mono-isotopic peaks
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Formula C23H20FN3O3
InChI InChI=1S/C23H20FN3O3/c1-29-21-5-3-2-4-19(21)26-10-12-27(13-11-26)20-14-22(30-23(28)18(20)15-25)16-6-8-17(24)9-7-16/h2-9,14H,10-13H2,1H3
InChIKey LLSNOGVXSLANBY-UHFFFAOYSA-N
Molecular Weight 405.429 g/mol
SMILES C1(=C(C=C(OC1=O)c1ccc(cc1)F)N1CCN(CC1)c1c(OC)cccc1)C#N
SPLASH splash10-0nmi-0600900000-4e8116793485d9ce54ad
Source of Spectrum K-2001-1957-5
Wiley ID 1579466