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(2S,2''R)-1-[N-Methoxycarbonyl-N-(1-methyl-3-phenylpropyl)amino]-2-(methoxymethyl)pyrrolidine

View entire compound with spectra: 1 NMR, and 1 MS (GC)

(2S,2''R)-1-[N-Methoxycarbonyl-N-(1-methyl-3-phenylpropyl)amino]-2-(methoxymethyl)pyrrolidine
SpectraBase Compound ID DcOSpJw8UMs
InChI InChI=1S/C18H28N2O3/c1-15(11-12-16-8-5-4-6-9-16)20(18(21)23-3)19-13-7-10-17(19)14-22-2/h4-6,8-9,15,17H,7,10-14H2,1-3H3/t15-,17+/m1/s1
InChIKey QNYAKKHUYGRHEZ-WBVHZDCISA-N
Mol Weight 320.43 g/mol
Molecular Formula C18H28N2O3
Exact Mass 320.209993 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8bDaSihONv5
Name (2S,2''R)-1-[N-Methoxycarbonyl-N-(1-methyl-3-phenylpropyl)amino]-2-(methoxymethyl)pyrrolidine
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 320.209992767 u
Formula C18H28N2O3
InChI InChI=1S/C18H28N2O3/c1-15(11-12-16-8-5-4-6-9-16)20(18(21)23-3)19-13-7-10-17(19)14-22-2/h4-6,8-9,15,17H,7,10-14H2,1-3H3/t15-,17+/m1/s1
InChIKey QNYAKKHUYGRHEZ-WBVHZDCISA-N
Molecular Weight 320.433 g/mol
SMILES C(N(N1[C@](COC)(CCC1)[H])[C@@](CCC1=CC=CC=C1)(C)[H])(=O)OC