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3-[(4-Fluorobenzyl)amino]-1-phenyl-2,5-pyrrolidinedione, ac derivative
SpectraBase Compound ID 2IyIY81m8GH
InChI InChI=1S/C19H17FN2O3/c1-13(23)21(12-14-7-9-15(20)10-8-14)17-11-18(24)22(19(17)25)16-5-3-2-4-6-16/h2-10,17H,11-12H2,1H3
InChIKey OBLHFDUFKWWUOC-UHFFFAOYSA-N
Mol Weight 340.35 g/mol
Molecular Formula C19H17FN2O3
Exact Mass 340.122321 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6sWHvISFTPm
Name 3-[(4-Fluorobenzyl)amino]-1-phenyl-2,5-pyrrolidinedione, ac derivative
Comments Computed using HOSE algorithm
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Exact Mass 340.122320575 u
Formula C19H17FN2O3
InChI InChI=1S/C19H17FN2O3/c1-13(23)21(12-14-7-9-15(20)10-8-14)17-11-18(24)22(19(17)25)16-5-3-2-4-6-16/h2-10,17H,11-12H2,1H3
InChIKey OBLHFDUFKWWUOC-UHFFFAOYSA-N
Molecular Weight 340.354 g/mol
SMILES C1(F)=CC=C(C=C1)CN(C1CC(=O)N(C1=O)C1=CC=CC=C1)C(C)=O