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Propanoic acid, 3,3-diphenyl-, (octahydro-2H-quinolizin-1-yl) ester
SpectraBase Compound ID 32aRXR8BEVz
InChI InChI=1S/C25H31NO2/c27-25(28-19-22-14-9-17-26-16-8-7-15-24(22)26)18-23(20-10-3-1-4-11-20)21-12-5-2-6-13-21/h1-6,10-13,22-24H,7-9,14-19H2
InChIKey BIKPQARVLUMBGS-UHFFFAOYSA-N
Mol Weight 377.53 g/mol
Molecular Formula C25H31NO2
Exact Mass 377.235479 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8CfonUHcDb4
Name Propanoic acid, 3,3-diphenyl-, (octahydro-2H-quinolizin-1-yl) ester
Comments Computed using HOSE algorithm
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Exact Mass 377.235479240 u
Formula C25H31NO2
InChI InChI=1S/C25H31NO2/c27-25(28-19-22-14-9-17-26-16-8-7-15-24(22)26)18-23(20-10-3-1-4-11-20)21-12-5-2-6-13-21/h1-6,10-13,22-24H,7-9,14-19H2
InChIKey BIKPQARVLUMBGS-UHFFFAOYSA-N
Molecular Weight 377.528 g/mol
SMILES C1=CC=C(C(CC(OCC2C3N(CCC2)CCCC3)=O)C=2C=CC=CC2)C=C1