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N-(3,5-Dimethoxyphenyl)-1-tosylpiperidine-3-carboxamide

View entire compound with spectra: 1 NMR

N-(3,5-Dimethoxyphenyl)-1-tosylpiperidine-3-carboxamide
SpectraBase Compound ID KfJ3YSPbZT7
InChI InChI=1S/C21H26N2O5S/c1-15-6-8-20(9-7-15)29(25,26)23-10-4-5-16(14-23)21(24)22-17-11-18(27-2)13-19(12-17)28-3/h6-9,11-13,16H,4-5,10,14H2,1-3H3,(H,22,24)
InChIKey JVYQDWRVJCFZJS-UHFFFAOYSA-N
Mol Weight 418.51 g/mol
Molecular Formula C21H26N2O5S
Exact Mass 418.156243 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LRNXM1pPrSj
Name N-(3,5-Dimethoxyphenyl)-1-tosylpiperidine-3-carboxamide
Comments Computed using HOSE algorithm
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Exact Mass 418.156243114 u
Formula C21H26N2O5S
InChI InChI=1S/C21H26N2O5S/c1-15-6-8-20(9-7-15)29(25,26)23-10-4-5-16(14-23)21(24)22-17-11-18(27-2)13-19(12-17)28-3/h6-9,11-13,16H,4-5,10,14H2,1-3H3,(H,22,24)
InChIKey JVYQDWRVJCFZJS-UHFFFAOYSA-N
Molecular Weight 418.508 g/mol
SMILES C1N(CCCC1C(=O)NC1=CC(=CC(=C1)OC)OC)S(=O)(=O)C1=CC=C(C)C=C1