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N-[2-(4-acetyl-1-piperazinyl)phenyl]-4-ethoxybenzamide
SpectraBase Compound ID IIruLRl4jqS
InChI InChI=1S/C21H25N3O3/c1-3-27-18-10-8-17(9-11-18)21(26)22-19-6-4-5-7-20(19)24-14-12-23(13-15-24)16(2)25/h4-11H,3,12-15H2,1-2H3,(H,22,26)
InChIKey WTGPFGAKVRJNGA-UHFFFAOYSA-N
Mol Weight 367.45 g/mol
Molecular Formula C21H25N3O3
Exact Mass 367.189592 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FZNid0obDKz
Name N-[2-(4-Acetyl-1-piperazinyl)phenyl]-4-ethoxybenzamide
Comments Computed using HOSE algorithm
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Exact Mass 367.189591674 u
Formula C21H25N3O3
InChI InChI=1S/C21H25N3O3/c1-3-27-18-10-8-17(9-11-18)21(26)22-19-6-4-5-7-20(19)24-14-12-23(13-15-24)16(2)25/h4-11H,3,12-15H2,1-2H3,(H,22,26)
InChIKey WTGPFGAKVRJNGA-UHFFFAOYSA-N
Molecular Weight 367.449 g/mol
SMILES N(C(C1=CC=C(C=C1)OCC)=O)C1=C(N2CCN(C(=O)C)CC2)C=CC=C1