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1-piperazinamine, 4-[(4-methylphenyl)methyl]-N-[(E,2E)-3-phenyl-2-propenylidene]-
SpectraBase Compound ID IXfJIYyJQBP
InChI InChI=1S/C21H25N3/c1-19-9-11-21(12-10-19)18-23-14-16-24(17-15-23)22-13-5-8-20-6-3-2-4-7-20/h2-13H,14-18H2,1H3/b8-5+,22-13+
InChIKey XXFYHFJWJOOBED-OWTPYQNBSA-N
Mol Weight 319.45 g/mol
Molecular Formula C21H25N3
Exact Mass 319.204848 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5OX6zpIMMxh
Name 1-Piperazinamine, 4-[(4-methylphenyl)methyl]-N-[(E,2E)-3-phenyl-2-propenylidene]-
Comments Computed using HOSE algorithm
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Exact Mass 319.204847817 u
Formula C21H25N3
InChI InChI=1S/C21H25N3/c1-19-9-11-21(12-10-19)18-23-14-16-24(17-15-23)22-13-5-8-20-6-3-2-4-7-20/h2-13H,14-18H2,1H3/b8-5+,22-13+
InChIKey XXFYHFJWJOOBED-OWTPYQNBSA-N
Molecular Weight 319.452 g/mol
SMILES C1=CC=C(\C=C\C=N\N2CCN(CC2)CC2=CC=C(C=C2)C)C=C1