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2-[[2-[4-[2-(4-fluorophenyl)-1-oxoethyl]-1-piperazinyl]ethylamino]methylidene]-5,5-dimethylcyclohexane-1,3-dione
SpectraBase Compound ID KiEGcr5tRPT
InChI InChI=1S/C23H30FN3O3/c1-23(2)14-20(28)19(21(29)15-23)16-25-7-8-26-9-11-27(12-10-26)22(30)13-17-3-5-18(24)6-4-17/h3-6,16,25H,7-15H2,1-2H3
InChIKey YBXQDMXOWVSQGJ-UHFFFAOYSA-N
Mol Weight 415.51 g/mol
Molecular Formula C23H30FN3O3
Exact Mass 415.22712 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GocNlzuDRrm
Name 2-[[2-[4-[2-(4-fluorophenyl)-1-oxoethyl]-1-piperazinyl]ethylamino]methylidene]-5,5-dimethylcyclohexane-1,3-dione
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Formula C23H30FN3O3
InChI InChI=1S/C23H30FN3O3/c1-23(2)14-20(28)19(21(29)15-23)16-25-7-8-26-9-11-27(12-10-26)22(30)13-17-3-5-18(24)6-4-17/h3-6,16,25H,7-15H2,1-2H3
InChIKey YBXQDMXOWVSQGJ-UHFFFAOYSA-N
Molecular Weight 415.509 g/mol
SMILES N(CCN1CCN(CC1)C(=O)Cc1ccc(cc1)F)C=C1C(CC(CC1=O)(C)C)=O
SPLASH splash10-052r-9550000000-c287bffb9fbbadfea64b
Synonyms 2-[[2-[4-[2-(4-fluorophenyl)acetyl]piperazin-1-yl]ethylamino]methylidene]-5,5-dimethylcyclohexane-1,3-dione 2-[[2-[4-[2-(4-fluorophenyl)acetyl]piperazino]ethylamino]methylene]-5,5-dimethyl-cyclohexane-1,3-quinone 2-[[2-[4-[2-(4-fluorophenyl)ethanoyl]piperazin-1-yl]ethylamino]methylidene]-5,5-dimethyl-cyclohexane-1,3-dione
Wiley ID 1438721