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1-Pyrrolidinecarboxylic acid, 2-[[(3-fluorophenyl)amino]carbonyl]-, phenylmethyl ester

View entire compound with spectra: 2 NMR

1-Pyrrolidinecarboxylic acid, 2-[[(3-fluorophenyl)amino]carbonyl]-, phenylmethyl ester
SpectraBase Compound ID EstNRWpVxDo
InChI InChI=1S/C19H19FN2O3/c20-15-8-4-9-16(12-15)21-18(23)17-10-5-11-22(17)19(24)25-13-14-6-2-1-3-7-14/h1-4,6-9,12,17H,5,10-11,13H2,(H,21,23)
InChIKey YGVVXTMULDGZCD-UHFFFAOYSA-N
Mol Weight 342.37 g/mol
Molecular Formula C19H19FN2O3
Exact Mass 342.137971 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 56n5SiKIHU4
Name 1-Pyrrolidinecarboxylic acid, 2-[[(3-fluorophenyl)amino]carbonyl]-, phenylmethyl ester
Comments Computed using HOSE algorithm
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Exact Mass 342.137970640 u
Formula C19H19FN2O3
InChI InChI=1S/C19H19FN2O3/c20-15-8-4-9-16(12-15)21-18(23)17-10-5-11-22(17)19(24)25-13-14-6-2-1-3-7-14/h1-4,6-9,12,17H,5,10-11,13H2,(H,21,23)
InChIKey YGVVXTMULDGZCD-UHFFFAOYSA-N
Molecular Weight 342.370 g/mol
SMILES N(C(C1N(C(OCC2=CC=CC=C2)=O)CCC1)=O)C1=CC(F)=CC=C1