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N-(2-Methylphenyl)-N-([(2-thiophen-2-yl)ethyl]piperidin-1-yl)-2-methylpropanamide
SpectraBase Compound ID KqSaRXfrksE
InChI InChI=1S/C22H30N2OS/c1-17(2)22(25)24(21-9-5-4-7-18(21)3)19-10-13-23(14-11-19)15-12-20-8-6-16-26-20/h4-9,16-17,19H,10-15H2,1-3H3
InChIKey NZJYPQASGVDQOS-UHFFFAOYSA-N
Mol Weight 370.56 g/mol
Molecular Formula C22H30N2OS
Exact Mass 370.207885 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4HnIg7zvi0A
Name N-(2-Methylphenyl)-N-{[(2-thiophen-2-yl)ethyl]piperidin-1-yl}-2-methylpropanamide
Comments Computed using HOSE algorithm
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Exact Mass 370.207884767 u
Formula C22H30N2OS
InChI InChI=1S/C22H30N2OS/c1-17(2)22(25)24(21-9-5-4-7-18(21)3)19-10-13-23(14-11-19)15-12-20-8-6-16-26-20/h4-9,16-17,19H,10-15H2,1-3H3
InChIKey NZJYPQASGVDQOS-UHFFFAOYSA-N
Molecular Weight 370.555 g/mol
SMILES C=1(N(C2CCN(CC2)CCC=2SC=CC2)C(C(C)C)=O)C(=CC=CC1)C