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4-Butyl-3-fluoro-1-anilino-isoquinoline
SpectraBase Compound ID 73rN2qiuPwB
InChI InChI=1S/C19H19FN2/c1-2-3-11-16-15-12-7-8-13-17(15)19(22-18(16)20)21-14-9-5-4-6-10-14/h4-10,12-13H,2-3,11H2,1H3,(H,21,22)
InChIKey GNEALSJSOLAPDZ-UHFFFAOYSA-N
Mol Weight 294.37 g/mol
Molecular Formula C19H19FN2
Exact Mass 294.153227 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 51cuLtqX4uy
Name 4-Butyl-3-fluoro-1-anilino-isoquinoline
Alternate Name(s) 4-Butyl-3-fluoro-N-phenylisoquinolin-1-amine 4-Butyl-3-fluoro-N-phenyl-1-isoquinolinamine 4-Butyl-3-fluoro-N-phenyl-isoquinolin-1-amine 4-Butyl-3-fluoranyl-N-phenyl-isoquinolin-1-amine
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Formula C19H19FN2
InChI InChI=1S/C19H19FN2/c1-2-3-11-16-15-12-7-8-13-17(15)19(22-18(16)20)21-14-9-5-4-6-10-14/h4-10,12-13H,2-3,11H2,1H3,(H,21,22)
InChIKey GNEALSJSOLAPDZ-UHFFFAOYSA-N
Molecular Weight 294.373 g/mol
SMILES N(c1nc(c(c2ccccc12)CCCC)F)c1ccccc1
SPLASH splash10-0udi-1090000000-cf9c158a74a957475d13
Source of Spectrum F5-5-3960-8a
Wiley ID 1733343