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3-piperidinecarboxamide, N-[4-methoxy-3-(2-methylpropoxy)phenyl]-1-(3-phenylpropyl)-
SpectraBase Compound ID 3dxO6OPJzWN
InChI InChI=1S/C26H36N2O3/c1-20(2)19-31-25-17-23(13-14-24(25)30-3)27-26(29)22-12-8-16-28(18-22)15-7-11-21-9-5-4-6-10-21/h4-6,9-10,13-14,17,20,22H,7-8,11-12,15-16,18-19H2,1-3H3,(H,27,29)
InChIKey JSXHJZHAZDOQRY-UHFFFAOYSA-N
Mol Weight 424.6 g/mol
Molecular Formula C26H36N2O3
Exact Mass 424.272593 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2wvolZUBLHp
Name 3-Piperidinecarboxamide, N-[4-methoxy-3-(2-methylpropoxy)phenyl]-1-(3-phenylpropyl)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 424.272593024 u
Formula C26H36N2O3
InChI InChI=1S/C26H36N2O3/c1-20(2)19-31-25-17-23(13-14-24(25)30-3)27-26(29)22-12-8-16-28(18-22)15-7-11-21-9-5-4-6-10-21/h4-6,9-10,13-14,17,20,22H,7-8,11-12,15-16,18-19H2,1-3H3,(H,27,29)
InChIKey JSXHJZHAZDOQRY-UHFFFAOYSA-N
Molecular Weight 424.585 g/mol
SMILES N(C(C1CN(CCCC=2C=CC=CC2)CCC1)=O)C1=CC(OCC(C)C)=C(C=C1)OC