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Piperidine-4-carboxylic acid, 4-phenyl-1-(p-tolylcarbamoylmethyl)-, ethyl ester
SpectraBase Compound ID KjdoNLiTwMH
InChI InChI=1S/C23H28N2O3/c1-3-28-22(27)23(19-7-5-4-6-8-19)13-15-25(16-14-23)17-21(26)24-20-11-9-18(2)10-12-20/h4-12H,3,13-17H2,1-2H3,(H,24,26)
InChIKey QXVOMKZKRFFDAG-UHFFFAOYSA-N
Mol Weight 380.49 g/mol
Molecular Formula C23H28N2O3
Exact Mass 380.209993 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID lOfwqkpPgw
Name Piperidine-4-carboxylic acid, 4-phenyl-1-(p-tolylcarbamoylmethyl)-, ethyl ester
Comments Computed using HOSE algorithm
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Exact Mass 380.209992767 u
Formula C23H28N2O3
InChI InChI=1S/C23H28N2O3/c1-3-28-22(27)23(19-7-5-4-6-8-19)13-15-25(16-14-23)17-21(26)24-20-11-9-18(2)10-12-20/h4-12H,3,13-17H2,1-2H3,(H,24,26)
InChIKey QXVOMKZKRFFDAG-UHFFFAOYSA-N
Molecular Weight 380.488 g/mol
SMILES C1(C(=O)OCC)(CCN(CC(NC2=CC=C(C)C=C2)=O)CC1)C1=CC=CC=C1