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(2S)-N-(Carbobenzyloxy)-2-[(2E)-(3,4-dimethoxyphenyl)ethenyl]piperidine

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(2S)-N-(Carbobenzyloxy)-2-[(2E)-(3,4-dimethoxyphenyl)ethenyl]piperidine
SpectraBase Compound ID KxP89DXsFqz
InChI InChI=1S/C23H27NO4/c1-26-21-14-12-18(16-22(21)27-2)11-13-20-10-6-7-15-24(20)23(25)28-17-19-8-4-3-5-9-19/h3-5,8-9,11-14,16,20H,6-7,10,15,17H2,1-2H3/b13-11+/t20-/m0/s1
InChIKey OBJUNDHSLXFYPV-RPAADVPWSA-N
Mol Weight 381.47 g/mol
Molecular Formula C23H27NO4
Exact Mass 381.194008 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID G20nAo17YCD
Name (2S)-N-(Carbobenzyloxy)-2-[(2E)-(3,4-dimethoxyphenyl)ethenyl]piperidine
Comments Computed using HOSE algorithm
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Exact Mass 381.194008349 u
Formula C23H27NO4
InChI InChI=1S/C23H27NO4/c1-26-21-14-12-18(16-22(21)27-2)11-13-20-10-6-7-15-24(20)23(25)28-17-19-8-4-3-5-9-19/h3-5,8-9,11-14,16,20H,6-7,10,15,17H2,1-2H3/b13-11+/t20-/m0/s1
InChIKey OBJUNDHSLXFYPV-RPAADVPWSA-N
Molecular Weight 381.472 g/mol
SMILES C(N1[C@](\C=C\C=2C=C(OC)C(=CC2)OC)(CCCC1)[H])(OCC1=CC=CC=C1)=O