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(R)-N-(3,4-Dimethylphenyl)-1-tosylpiperidine-2-carboxamide
SpectraBase Compound ID 79KFEcgURUZ
InChI InChI=1S/C21H26N2O3S/c1-15-7-11-19(12-8-15)27(25,26)23-13-5-4-6-20(23)21(24)22-18-10-9-16(2)17(3)14-18/h7-12,14,20H,4-6,13H2,1-3H3,(H,22,24)/t20-/m1/s1
InChIKey ZCXMKIGUMFVZKM-HXUWFJFHSA-N
Mol Weight 386.51 g/mol
Molecular Formula C21H26N2O3S
Exact Mass 386.166414 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LbsxO5GPaVn
Name (R)-N-(3,4-Dimethylphenyl)-1-tosylpiperidine-2-carboxamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 386.166413876 u
Formula C21H26N2O3S
InChI InChI=1S/C21H26N2O3S/c1-15-7-11-19(12-8-15)27(25,26)23-13-5-4-6-20(23)21(24)22-18-10-9-16(2)17(3)14-18/h7-12,14,20H,4-6,13H2,1-3H3,(H,22,24)/t20-/m1/s1
InChIKey ZCXMKIGUMFVZKM-HXUWFJFHSA-N
Molecular Weight 386.510 g/mol
SMILES [C@@]1(N(CCCC1)S(=O)(=O)C1=CC=C(C)C=C1)(C(=O)NC1=CC(=C(C=C1)C)C)[H]