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3-[(4-Fluorobenzyl)amino]-1-phenyl-2,5-pyrrolidinedione
SpectraBase Compound ID 6OglFTlEHfB
InChI InChI=1S/C17H15FN2O2/c18-13-8-6-12(7-9-13)11-19-15-10-16(21)20(17(15)22)14-4-2-1-3-5-14/h1-9,15,19H,10-11H2
InChIKey OAGXPHPNDYSICI-UHFFFAOYSA-N
Mol Weight 298.32 g/mol
Molecular Formula C17H15FN2O2
Exact Mass 298.111756 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8oso9lCa57N
Name 3-[(4-Fluorobenzyl)amino]-1-phenyl-2,5-pyrrolidinedione
Comments Computed using HOSE algorithm
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Exact Mass 298.111755892 u
Formula C17H15FN2O2
InChI InChI=1S/C17H15FN2O2/c18-13-8-6-12(7-9-13)11-19-15-10-16(21)20(17(15)22)14-4-2-1-3-5-14/h1-9,15,19H,10-11H2
InChIKey OAGXPHPNDYSICI-UHFFFAOYSA-N
Molecular Weight 298.317 g/mol
SMILES C1(N(C(CC1NCC1=CC=C(C=C1)F)=O)C1=CC=CC=C1)=O