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phenol, 2-bromo-4-[(E)-[[4-[(4-chlorophenyl)methyl]-1-piperazinyl]imino]methyl]-6-methoxy-
SpectraBase Compound ID JPbum82R9Sk
InChI InChI=1S/C19H21BrClN3O2/c1-26-18-11-15(10-17(20)19(18)25)12-22-24-8-6-23(7-9-24)13-14-2-4-16(21)5-3-14/h2-5,10-12,25H,6-9,13H2,1H3/b22-12+
InChIKey UJBOQTSCAQOGJW-WSDLNYQXSA-N
Mol Weight 438.75 g/mol
Molecular Formula C19H21BrClN3O2
Exact Mass 437.050568 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9A3IAZWME7i
Name Phenol, 2-bromo-4-[(E)-[[4-[(4-chlorophenyl)methyl]-1-piperazinyl]imino]methyl]-6-methoxy-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 437.050567626 u
Formula C19H21BrClN3O2
InChI InChI=1S/C19H21BrClN3O2/c1-26-18-11-15(10-17(20)19(18)25)12-22-24-8-6-23(7-9-24)13-14-2-4-16(21)5-3-14/h2-5,10-12,25H,6-9,13H2,1H3/b22-12+
InChIKey UJBOQTSCAQOGJW-WSDLNYQXSA-N
Molecular Weight 438.753 g/mol
SMILES OC1=C(C=C(C=C1OC)\C=N\N1CCN(CC1)CC=1C=CC(=CC1)Cl)Br