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1-piperazinamine, 4-[(4-chlorophenyl)methyl]-N-[(E,2Z)-2-chloro-3-phenyl-2-propenylidene]-
SpectraBase Compound ID LTg9CpCUy5f
InChI InChI=1S/C20H21Cl2N3/c21-19-8-6-18(7-9-19)16-24-10-12-25(13-11-24)23-15-20(22)14-17-4-2-1-3-5-17/h1-9,14-15H,10-13,16H2/b20-14-,23-15+
InChIKey BDPSNXCQQWFUHW-PDIADDBYSA-N
Mol Weight 374.32 g/mol
Molecular Formula C20H21Cl2N3
Exact Mass 373.111253 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GcdlCzkuQwY
Name 1-Piperazinamine, 4-[(4-chlorophenyl)methyl]-N-[(E,2Z)-2-chloro-3-phenyl-2-propenylidene]-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 373.111253088 u
Formula C20H21Cl2N3
InChI InChI=1S/C20H21Cl2N3/c21-19-8-6-18(7-9-19)16-24-10-12-25(13-11-24)23-15-20(22)14-17-4-2-1-3-5-17/h1-9,14-15H,10-13,16H2/b20-14-,23-15+
InChIKey BDPSNXCQQWFUHW-PDIADDBYSA-N
Molecular Weight 374.315 g/mol
SMILES C=1C=CC(\C=C\(\C=N\N2CCN(CC2)CC2=CC=C(C=C2)Cl)Cl)=CC1