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1-piperazinamine, N-[(E)-(3,4-dichlorophenyl)methylidene]-4-(2-methoxyphenyl)-
SpectraBase Compound ID DSYjwpjSk2E
InChI InChI=1S/C18H19Cl2N3O/c1-24-18-5-3-2-4-17(18)22-8-10-23(11-9-22)21-13-14-6-7-15(19)16(20)12-14/h2-7,12-13H,8-11H2,1H3/b21-13+
InChIKey ZOQOZUCGTQVCQN-FYJGNVAPSA-N
Mol Weight 364.28 g/mol
Molecular Formula C18H19Cl2N3O
Exact Mass 363.090518 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Ba43ir9rGoi
Name 1-Piperazinamine, N-[(E)-(3,4-dichlorophenyl)methylidene]-4-(2-methoxyphenyl)-
Comments Computed using HOSE algorithm
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Exact Mass 363.090517643 u
Formula C18H19Cl2N3O
InChI InChI=1S/C18H19Cl2N3O/c1-24-18-5-3-2-4-17(18)22-8-10-23(11-9-22)21-13-14-6-7-15(19)16(20)12-14/h2-7,12-13H,8-11H2,1H3/b21-13+
InChIKey ZOQOZUCGTQVCQN-FYJGNVAPSA-N
Molecular Weight 364.276 g/mol
SMILES C1=CC=C(N2CCN(CC2)\N=C\C=2C=C(Cl)C(=CC2)Cl)C(OC)=C1