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4-{2-[bis(p-fluorophenyl)methoxy]ethyl}-1-piperazinepropionic acid, maleate(1:2)
SpectraBase Compound ID KeXOgHdGMeR
InChI InChI=1S/C22H26F2N2O3.2C4H4O4/c23-19-5-1-17(2-6-19)22(18-3-7-20(24)8-4-18)29-16-15-26-13-11-25(12-14-26)10-9-21(27)28;2*5-3(6)1-2-4(7)8/h1-8,22H,9-16H2,(H,27,28);2*1-2H,(H,5,6)(H,7,8)/b;2*2-1-
InChIKey HYWRMUHFEVEJQI-SPIKMXEPSA-N
Mol Weight 636.6 g/mol
Molecular Formula C30H34F2N2O11
Exact Mass 636.213066 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FXIbmoGUSMY
Name 4-{2-[bis(p-fluorophenyl)methoxy]ethyl}-1-piperazinepropionic acid, maleate(1:2)
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Formula C30H34F2N2O11
InChI InChI=1S/C22H26F2N2O3.2C4H4O4/c23-19-5-1-17(2-6-19)22(18-3-7-20(24)8-4-18)29-16-15-26-13-11-25(12-14-26)10-9-21(27)28;2*5-3(6)1-2-4(7)8/h1-8,22H,9-16H2,(H,27,28);2*1-2H,(H,5,6)(H,7,8)/b;2*2-1-
InChIKey HYWRMUHFEVEJQI-SPIKMXEPSA-N
Instrument Name Varian CFT-20
Sadtler NMR Number 35234M
Solvent Polysol