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Ethyl 4-{2,5-dioxo-3-[(3-phenylpropyl)amino]-1-pyrrolidinyl}benzoate
SpectraBase Compound ID 4T3zCqooQ9i
InChI InChI=1S/C22H24N2O4/c1-2-28-22(27)17-10-12-18(13-11-17)24-20(25)15-19(21(24)26)23-14-6-9-16-7-4-3-5-8-16/h3-5,7-8,10-13,19,23H,2,6,9,14-15H2,1H3
InChIKey YDKMMPLCMDWKOP-UHFFFAOYSA-N
Mol Weight 380.44 g/mol
Molecular Formula C22H24N2O4
Exact Mass 380.173607 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CYL9ERTc9u2
Name Ethyl 4-{2,5-dioxo-3-[(3-phenylpropyl)amino]-1-pyrrolidinyl}benzoate
Comments Computed using HOSE algorithm
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Exact Mass 380.173607257 u
Formula C22H24N2O4
InChI InChI=1S/C22H24N2O4/c1-2-28-22(27)17-10-12-18(13-11-17)24-20(25)15-19(21(24)26)23-14-6-9-16-7-4-3-5-8-16/h3-5,7-8,10-13,19,23H,2,6,9,14-15H2,1H3
InChIKey YDKMMPLCMDWKOP-UHFFFAOYSA-N
Molecular Weight 380.444 g/mol
SMILES N(C1C(N(C(C1)=O)C=1C=CC(C(=O)OCC)=CC1)=O)CCCC1=CC=CC=C1