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1-piperazinamine, N-[(E)-(2,6-dichlorophenyl)methylidene]-4-(1-naphthalenylmethyl)-
SpectraBase Compound ID 54WiZb9Xkb8
InChI InChI=1S/C22H21Cl2N3/c23-21-9-4-10-22(24)20(21)15-25-27-13-11-26(12-14-27)16-18-7-3-6-17-5-1-2-8-19(17)18/h1-10,15H,11-14,16H2/b25-15+
InChIKey BBXCKZDKXPXHFJ-MFKUBSTISA-N
Mol Weight 398.34 g/mol
Molecular Formula C22H21Cl2N3
Exact Mass 397.111253 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CopQQpHGzx9
Name 1-Piperazinamine, N-[(E)-(2,6-dichlorophenyl)methylidene]-4-(1-naphthalenylmethyl)-
Comments Computed using HOSE algorithm
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Exact Mass 397.111253088 u
Formula C22H21Cl2N3
InChI InChI=1S/C22H21Cl2N3/c23-21-9-4-10-22(24)20(21)15-25-27-13-11-26(12-14-27)16-18-7-3-6-17-5-1-2-8-19(17)18/h1-10,15H,11-14,16H2/b25-15+
InChIKey BBXCKZDKXPXHFJ-MFKUBSTISA-N
Molecular Weight 398.337 g/mol
SMILES C=1(\C=N\N2CCN(CC2)CC=2C3=C(C=CC=C3)C=CC2)C(Cl)=CC=CC1Cl