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2,4-diiodo-6-((E)-{[4-(2-methoxyphenyl)-1-piperazinyl]imino}methyl)phenol

View entire compound with spectra: 2 NMR

2,4-diiodo-6-((E)-{[4-(2-methoxyphenyl)-1-piperazinyl]imino}methyl)phenol
SpectraBase Compound ID 7LcYbxITr9c
InChI InChI=1S/C18H19I2N3O2/c1-25-17-5-3-2-4-16(17)22-6-8-23(9-7-22)21-12-13-10-14(19)11-15(20)18(13)24/h2-5,10-12,24H,6-9H2,1H3/b21-12+
InChIKey UUHLNZNUSPICLO-CIAFOILYSA-N
Mol Weight 563.18 g/mol
Molecular Formula C18H19I2N3O2
Exact Mass 562.956667 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 65KcXp3anoh
Name 2,4-Diiodo-6-((E)-{[4-(2-methoxyphenyl)-1-piperazinyl]imino}methyl)phenol
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 562.956666862 u
Formula C18H19I2N3O2
InChI InChI=1S/C18H19I2N3O2/c1-25-17-5-3-2-4-16(17)22-6-8-23(9-7-22)21-12-13-10-14(19)11-15(20)18(13)24/h2-5,10-12,24H,6-9H2,1H3/b21-12+
InChIKey UUHLNZNUSPICLO-CIAFOILYSA-N
Molecular Weight 563.178 g/mol
SMILES OC=1C(I)=CC(=CC1\C=N\N1CCN(CC1)C=1C(OC)=CC=CC1)I