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1-[4-[4-(2-Bromo-benzoyl)-piperazin-1-yl]-3-fluoro-phenyl]-butan-1-one
SpectraBase Compound ID IPfUwXenVlj
InChI InChI=1S/C21H22BrFN2O2/c1-2-5-20(26)15-8-9-19(18(23)14-15)24-10-12-25(13-11-24)21(27)16-6-3-4-7-17(16)22/h3-4,6-9,14H,2,5,10-13H2,1H3
InChIKey SNEUCIJXPGWCJU-UHFFFAOYSA-N
Mol Weight 433.32 g/mol
Molecular Formula C21H22BrFN2O2
Exact Mass 432.084869 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7so6DmMrirX
Name 1-[4-[4-(2-Bromo-benzoyl)-piperazin-1-yl]-3-fluoro-phenyl]-butan-1-one
Alternate Name(s) 1-(4-[4-(2-Bromobenzoyl)-1-piperazinyl]-3-fluorophenyl)-1-butanone 1-[4-[4-(2-bromobenzoyl)piperazino]-3-fluoro-phenyl]butan-1-one 1-[4-[4-(2-bromophenyl)carbonylpiperazin-1-yl]-3-fluoranyl-phenyl]butan-1-one 1-[4-[4-[(2-bromophenyl)-oxomethyl]-1-piperazinyl]-3-fluorophenyl]-1-butanone 1-[4-[4-(2-bromobenzoyl)piperazin-1-yl]-3-fluorophenyl]butan-1-one
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Formula C21H22BrFN2O2
InChI InChI=1S/C21H22BrFN2O2/c1-2-5-20(26)15-8-9-19(18(23)14-15)24-10-12-25(13-11-24)21(27)16-6-3-4-7-17(16)22/h3-4,6-9,14H,2,5,10-13H2,1H3
InChIKey SNEUCIJXPGWCJU-UHFFFAOYSA-N
Molecular Weight 433.321 g/mol
SMILES C(c1c(Br)cccc1)(N1CCN(CC1)c1c(cc(cc1)C(=O)CCC)F)=O
SPLASH splash10-0ab9-7980100000-1f7b91b39c9e4d24bd9c
Wiley ID 1461981