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1-(1-Phenylprop-2-yl)-4-(3-methylphenyl)piperazine
SpectraBase Compound ID APXtLgMpWbI
InChI InChI=1S/C20H26N2/c1-17-7-6-10-20(15-17)22-13-11-21(12-14-22)18(2)16-19-8-4-3-5-9-19/h3-10,15,18H,11-14,16H2,1-2H3
InChIKey YKMFPQTZPYDNOE-UHFFFAOYSA-N
Mol Weight 294.44 g/mol
Molecular Formula C20H26N2
Exact Mass 294.209599 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ALJlCkLyKfQ
Name 1-(1-Phenylprop-2-yl)-4-(3-methylphenyl)piperazine
Comments Computed using HOSE algorithm
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Exact Mass 294.209598845 u
Formula C20H26N2
InChI InChI=1S/C20H26N2/c1-17-7-6-10-20(15-17)22-13-11-21(12-14-22)18(2)16-19-8-4-3-5-9-19/h3-10,15,18H,11-14,16H2,1-2H3
InChIKey YKMFPQTZPYDNOE-UHFFFAOYSA-N
SMILES C=1(N2CCN(C(CC=3C=CC=CC3)C)CC2)C=C(C=CC1)C