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4-[[13-(4-Hydroxy-3,5-diphenyl-benzyl)-1,4,10-trioxa-7,13-diazacyclopentadec-7-yl]methyl]-2,6-diphenyl-phenol

View entire compound with spectra: 1 NMR, and 1 MS (GC)

4-[[13-(4-Hydroxy-3,5-diphenyl-benzyl)-1,4,10-trioxa-7,13-diazacyclopentadec-7-yl]methyl]-2,6-diphenyl-phenol
SpectraBase Compound ID 8jPJxwFuInd
InChI InChI=1S/C48H50N2O5/c51-47-43(39-13-5-1-6-14-39)31-37(32-44(47)40-15-7-2-8-16-40)35-49-21-25-53-26-22-50(24-28-55-30-29-54-27-23-49)36-38-33-45(41-17-9-3-10-18-41)48(52)46(34-38)42-19-11-4-12-20-42/h1-20,31-34,51-52H,21-30,35-36H2
InChIKey LPQYHQXJEUYDJO-UHFFFAOYSA-N
Mol Weight 734.9 g/mol
Molecular Formula C48H50N2O5
Exact Mass 734.371973 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AesGZTKR6CT
Name 4-[[13-(4-Hydroxy-3,5-diphenyl-benzyl)-1,4,10-trioxa-7,13-diazacyclopentadec-7-yl]methyl]-2,6-diphenyl-phenol
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 734.371972713 u
Formula C48H50N2O5
InChI InChI=1S/C48H50N2O5/c51-47-43(39-13-5-1-6-14-39)31-37(32-44(47)40-15-7-2-8-16-40)35-49-21-25-53-26-22-50(24-28-55-30-29-54-27-23-49)36-38-33-45(41-17-9-3-10-18-41)48(52)46(34-38)42-19-11-4-12-20-42/h1-20,31-34,51-52H,21-30,35-36H2
InChIKey LPQYHQXJEUYDJO-UHFFFAOYSA-N
Molecular Weight 734.937 g/mol
SMILES C1(=C(C=C(C=C1C1=CC=CC=C1)CN1CCOCCN(CC=2C=C(C=3C=CC=CC3)C(=C(C2)C=2C=CC=CC2)O)CCOCCOCC1)C1=CC=CC=C1)O