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N-Phenyl-N-(1-[2-(thiophen-2-yl)ethyl]piperidin-4-yl)cyclopropanecarboxamide
SpectraBase Compound ID 8J3hXaChOCD
InChI InChI=1S/C21H26N2OS/c24-21(17-8-9-17)23(18-5-2-1-3-6-18)19-10-13-22(14-11-19)15-12-20-7-4-16-25-20/h1-7,16-17,19H,8-15H2
InChIKey KAWFIIQYYQWPJB-UHFFFAOYSA-N
Mol Weight 354.51 g/mol
Molecular Formula C21H26N2OS
Exact Mass 354.176585 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HfHvPnWsahl
Name N-Phenyl-N-(1-[2-(thiophen-2-yl)ethyl]piperidin-4-yl)cyclopropanecarboxamide
Comments Computed using HOSE algorithm
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Exact Mass 354.176584638 u
Formula C21H26N2OS
InChI InChI=1S/C21H26N2OS/c24-21(17-8-9-17)23(18-5-2-1-3-6-18)19-10-13-22(14-11-19)15-12-20-7-4-16-25-20/h1-7,16-17,19H,8-15H2
InChIKey KAWFIIQYYQWPJB-UHFFFAOYSA-N
Molecular Weight 354.512 g/mol
SMILES C(N(C1CCN(CC1)CCC=1SC=CC1)C=1C=CC=CC1)(C1CC1)=O