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

*Links on SpectraBase are not permalinks.

2,2-bis[4-[[4-Chloro-6-(3-ethynylphenoxy)-1,3,5-triazin-2-yl]oxy]phenyl]propane

View entire compound with spectra: 1 NMR

2,2-bis[4-[[4-Chloro-6-(3-ethynylphenoxy)-1,3,5-triazin-2-yl]oxy]phenyl]propane
SpectraBase Compound ID 66cWlL3r7UA
InChI InChI=1S/C37H24Cl2N6O4/c1-5-23-9-7-11-29(21-23)48-35-42-31(38)40-33(44-35)46-27-17-13-25(14-18-27)37(3,4)26-15-19-28(20-16-26)47-34-41-32(39)43-36(45-34)49-30-12-8-10-24(6-2)22-30/h1-2,7-22H,3-4H3
InChIKey FVUXHHAQAMYUHC-UHFFFAOYSA-N
Mol Weight 687.5 g/mol
Molecular Formula C37H24Cl2N6O4
Exact Mass 686.123609 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 27eIDlnt0t5
Name 2,2-bis[4-[[4-Chloro-6-(3-ethynylphenoxy)-1,3,5-triazin-2-yl]oxy]phenyl]propane
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 686.123608673 u
Formula C37H24Cl2N6O4
InChI InChI=1S/C37H24Cl2N6O4/c1-5-23-9-7-11-29(21-23)48-35-42-31(38)40-33(44-35)46-27-17-13-25(14-18-27)37(3,4)26-15-19-28(20-16-26)47-34-41-32(39)43-36(45-34)49-30-12-8-10-24(6-2)22-30/h1-2,7-22H,3-4H3
InChIKey FVUXHHAQAMYUHC-UHFFFAOYSA-N
SMILES C1(=NC(=NC(=N1)Cl)OC1=CC(=CC=C1)C#C)OC1=CC=C(C=C1)C(C1=CC=C(C=C1)OC1=NC(=NC(=N1)Cl)OC1=CC(=CC=C1)C#C)(C)C