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Acetamide, N-[2-[4-(4-phenyl)-1-piperidylsulfonyl)phenyl]ethyl]-
SpectraBase Compound ID 6QJei2vQBy4
InChI InChI=1S/C21H26N2O3S/c1-17(24)22-14-11-18-7-9-21(10-8-18)27(25,26)23-15-12-20(13-16-23)19-5-3-2-4-6-19/h2-10,20H,11-16H2,1H3,(H,22,24)
InChIKey KUKMIJTYSFLTQJ-UHFFFAOYSA-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 CJihnnFEPY6
Name Acetamide, N-[2-[4-(4-phenyl)-1-piperidylsulfonyl)phenyl]ethyl]-
Comments Computed using HOSE algorithm
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Exact Mass 386.166413876 u
Formula C21H26N2O3S
InChI InChI=1S/C21H26N2O3S/c1-17(24)22-14-11-18-7-9-21(10-8-18)27(25,26)23-15-12-20(13-16-23)19-5-3-2-4-6-19/h2-10,20H,11-16H2,1H3,(H,22,24)
InChIKey KUKMIJTYSFLTQJ-UHFFFAOYSA-N
Molecular Weight 386.510 g/mol
SMILES C1=CC=C(C=C1)C1CCN(S(C2=CC=C(C=C2)CCNC(=O)C)(=O)=O)CC1