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1-piperazineacetamide, 4-(4-fluorophenyl)-N-(4-phenoxyphenyl)-
SpectraBase Compound ID B2x5sfK3BMs
InChI InChI=1S/C24H24FN3O2/c25-19-6-10-21(11-7-19)28-16-14-27(15-17-28)18-24(29)26-20-8-12-23(13-9-20)30-22-4-2-1-3-5-22/h1-13H,14-18H2,(H,26,29)
InChIKey HIKYXSNYPKKEAS-UHFFFAOYSA-N
Mol Weight 405.47 g/mol
Molecular Formula C24H24FN3O2
Exact Mass 405.185255 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BRvnlibpoqh
Name 1-Piperazineacetamide, 4-(4-fluorophenyl)-N-(4-phenoxyphenyl)-
Comments Computed using HOSE algorithm
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Exact Mass 405.185255186 u
Formula C24H24FN3O2
InChI InChI=1S/C24H24FN3O2/c25-19-6-10-21(11-7-19)28-16-14-27(15-17-28)18-24(29)26-20-8-12-23(13-9-20)30-22-4-2-1-3-5-22/h1-13H,14-18H2,(H,26,29)
InChIKey HIKYXSNYPKKEAS-UHFFFAOYSA-N
Molecular Weight 405.473 g/mol
SMILES N(C(CN1CCN(C=2C=CC(=CC2)F)CC1)=O)C=1C=CC(OC2=CC=CC=C2)=CC1