For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

N,N'-bis-(4-Octyloxybenzylidene)-2-chloro-1,4-phenylenediamine

View entire compound with spectra: 1 NMR

N,N'-bis-(4-Octyloxybenzylidene)-2-chloro-1,4-phenylenediamine
SpectraBase Compound ID G6CJkFYZ3jw
InChI InChI=1S/C36H47ClN2O2/c1-3-5-7-9-11-13-25-40-33-20-15-30(16-21-33)28-38-32-19-24-36(35(37)27-32)39-29-31-17-22-34(23-18-31)41-26-14-12-10-8-6-4-2/h15-24,27-29H,3-14,25-26H2,1-2H3/b38-28+,39-29+
InChIKey MDHKESNCDKIVKS-IRKUSUMASA-N
Mol Weight 575.2 g/mol
Molecular Formula C36H47ClN2O2
Exact Mass 574.332606 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID GufyTRxwoaZ
Name N,N'-bis-(4-Octyloxybenzylidene)-2-chloro-1,4-phenylenediamine
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 574.332606459 u
Formula C36H47ClN2O2
InChI InChI=1S/C36H47ClN2O2/c1-3-5-7-9-11-13-25-40-33-20-15-30(16-21-33)28-38-32-19-24-36(35(37)27-32)39-29-31-17-22-34(23-18-31)41-26-14-12-10-8-6-4-2/h15-24,27-29H,3-14,25-26H2,1-2H3/b38-28+,39-29+
InChIKey MDHKESNCDKIVKS-IRKUSUMASA-N
Molecular Weight 575.237 g/mol
SMILES C1(=CC=C(C=C1)OCCCCCCCC)\C=N\C1=CC(=C(\N=C\C2=CC=C(C=C2)OCCCCCCCC)C=C1)Cl