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1-[(2-Methoxy-1-naphthyl)methyl]-4-(3-methylbutanoyl)piperazine
SpectraBase Compound ID GFxpRii9V0P
InChI InChI=1S/C21H28N2O2/c1-16(2)14-21(24)23-12-10-22(11-13-23)15-19-18-7-5-4-6-17(18)8-9-20(19)25-3/h4-9,16H,10-15H2,1-3H3
InChIKey BTFBXQDTZQWZKR-UHFFFAOYSA-N
Mol Weight 340.47 g/mol
Molecular Formula C21H28N2O2
Exact Mass 340.215078 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 62gs9OVxdMr
Name 1-[(2-Methoxy-1-naphthyl)methyl]-4-(3-methylbutanoyl)piperazine
Comments Computed using HOSE algorithm
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Exact Mass 340.215078148 u
Formula C21H28N2O2
InChI InChI=1S/C21H28N2O2/c1-16(2)14-21(24)23-12-10-22(11-13-23)15-19-18-7-5-4-6-17(18)8-9-20(19)25-3/h4-9,16H,10-15H2,1-3H3
InChIKey BTFBXQDTZQWZKR-UHFFFAOYSA-N
Molecular Weight 340.467 g/mol
SMILES C=1C=CC2=C(C(CN3CCN(C(CC(C)C)=O)CC3)=C(C=C2)OC)C1