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Benzamide, N-[2-(dimethylamino)ethyl]-4-fluoro-N-[(3R,4R)-3-hydroxy-1-(phenylmethyl)-4-piperidinyl]-
SpectraBase Compound ID 3oGRtsKQGd6
InChI InChI=1S/C23H30FN3O2/c1-25(2)14-15-27(23(29)19-8-10-20(24)11-9-19)21-12-13-26(17-22(21)28)16-18-6-4-3-5-7-18/h3-11,21-22,28H,12-17H2,1-2H3
InChIKey XNUUMPSIBUALRV-UHFFFAOYSA-N
Mol Weight 399.51 g/mol
Molecular Formula C23H30FN3O2
Exact Mass 399.232205 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AuVLMxQnXhJ
Name Benzamide, N-[2-(dimethylamino)ethyl]-4-fluoro-N-[(3R,4R)-3-hydroxy-1-(phenylmethyl)-4-piperidinyl]-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 399.232205379 u
Formula C23H30FN3O2
InChI InChI=1S/C23H30FN3O2/c1-25(2)14-15-27(23(29)19-8-10-20(24)11-9-19)21-12-13-26(17-22(21)28)16-18-6-4-3-5-7-18/h3-11,21-22,28H,12-17H2,1-2H3
InChIKey XNUUMPSIBUALRV-UHFFFAOYSA-N
Molecular Weight 399.510 g/mol
SMILES C1=CC=C(C=C1)CN1CCC(N(C(C2=CC=C(C=C2)F)=O)CCN(C)C)C(C1)O