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1-(4-Isopropoxybenzoyl)-4-(2,3,4-trimethoxybenzyl)piperazine
SpectraBase Compound ID JglxbZPQ1wN
InChI InChI=1S/C24H32N2O5/c1-17(2)31-20-9-6-18(7-10-20)24(27)26-14-12-25(13-15-26)16-19-8-11-21(28-3)23(30-5)22(19)29-4/h6-11,17H,12-16H2,1-5H3
InChIKey BLRSZDYYWOGBJM-UHFFFAOYSA-N
Mol Weight 428.5 g/mol
Molecular Formula C24H32N2O5
Exact Mass 428.231122 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DQ8dyZlH8BJ
Name 1-(4-Isopropoxybenzoyl)-4-(2,3,4-trimethoxybenzyl)piperazine
Comments Computed using HOSE algorithm
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Exact Mass 428.231122133 u
Formula C24H32N2O5
InChI InChI=1S/C24H32N2O5/c1-17(2)31-20-9-6-18(7-10-20)24(27)26-14-12-25(13-15-26)16-19-8-11-21(28-3)23(30-5)22(19)29-4/h6-11,17H,12-16H2,1-5H3
InChIKey BLRSZDYYWOGBJM-UHFFFAOYSA-N
Molecular Weight 428.529 g/mol
SMILES C1(=C(C(CN2CCN(CC2)C(C=2C=CC(OC(C)C)=CC2)=O)=CC=C1OC)OC)OC