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phenol, 2-bromo-6-methoxy-4-[(E)-[(4-phenyl-1-piperazinyl)imino]methyl]-

View entire compound with spectra: 2 NMR

phenol, 2-bromo-6-methoxy-4-[(E)-[(4-phenyl-1-piperazinyl)imino]methyl]-
SpectraBase Compound ID 2Rt5UnKlX4c
InChI InChI=1S/C18H20BrN3O2/c1-24-17-12-14(11-16(19)18(17)23)13-20-22-9-7-21(8-10-22)15-5-3-2-4-6-15/h2-6,11-13,23H,7-10H2,1H3/b20-13+
InChIKey XKAVAODDDAYQIL-DEDYPNTBSA-N
Mol Weight 390.28 g/mol
Molecular Formula C18H20BrN3O2
Exact Mass 389.07389 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9A5MMOtQNT1
Name Phenol, 2-bromo-6-methoxy-4-[(E)-[(4-phenyl-1-piperazinyl)imino]methyl]-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 389.073889894 u
Formula C18H20BrN3O2
InChI InChI=1S/C18H20BrN3O2/c1-24-17-12-14(11-16(19)18(17)23)13-20-22-9-7-21(8-10-22)15-5-3-2-4-6-15/h2-6,11-13,23H,7-10H2,1H3/b20-13+
InChIKey XKAVAODDDAYQIL-DEDYPNTBSA-N
Molecular Weight 390.281 g/mol
SMILES OC1=C(C=C(C=C1OC)\C=N\N1CCN(CC1)C=1C=CC=CC1)Br