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N-4-Methylphenyl-N-(1-[2-(thiophen-2-yl)ethyl]piperidin-4-yl)cyclopropanecarboxamide
SpectraBase Compound ID hoR5Sx2J7u
InChI InChI=1S/C22H28N2OS/c1-17-4-8-19(9-5-17)24(22(25)18-6-7-18)20-10-13-23(14-11-20)15-12-21-3-2-16-26-21/h2-5,8-9,16,18,20H,6-7,10-15H2,1H3
InChIKey MDKROYANXLUYNI-UHFFFAOYSA-N
Mol Weight 368.54 g/mol
Molecular Formula C22H28N2OS
Exact Mass 368.192235 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 95mEZbucROp
Name N-4-Methylphenyl-N-(1-[2-(thiophen-2-yl)ethyl]piperidin-4-yl)cyclopropanecarboxamide
Comments Computed using HOSE algorithm
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Exact Mass 368.192234703 u
Formula C22H28N2OS
InChI InChI=1S/C22H28N2OS/c1-17-4-8-19(9-5-17)24(22(25)18-6-7-18)20-10-13-23(14-11-20)15-12-21-3-2-16-26-21/h2-5,8-9,16,18,20H,6-7,10-15H2,1H3
InChIKey MDKROYANXLUYNI-UHFFFAOYSA-N
Molecular Weight 368.539 g/mol
SMILES C(N(C1CCN(CC1)CCC=1SC=CC1)C1=CC=C(C=C1)C)(C1CC1)=O