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4-(4-Methoxyphenyl)-2,3,5,6-tetrakis((4-methoxyphenyl)ethynyl)-pyridine

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4-(4-Methoxyphenyl)-2,3,5,6-tetrakis((4-methoxyphenyl)ethynyl)-pyridine
SpectraBase Compound ID 7RvXXbhY3Nd
InChI InChI=1S/C48H35NO5/c1-50-39-20-6-34(7-21-39)14-30-44-46(32-16-36-10-24-41(52-3)25-11-36)49-47(33-17-37-12-26-42(53-4)27-13-37)45(31-15-35-8-22-40(51-2)23-9-35)48(44)38-18-28-43(54-5)29-19-38/h6-13,18-29H,1-5H3
InChIKey NBGMYRFNXYPHBD-UHFFFAOYSA-N
Mol Weight 705.8 g/mol
Molecular Formula C48H35NO5
Exact Mass 705.251523 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9SN3pLfuoVw
Name 4-(4-Methoxyphenyl)-2,3,5,6-tetrakis((4-methoxyphenyl)ethynyl)-pyridine
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 705.251523226 u
Formula C48H35NO5
InChI InChI=1S/C48H35NO5/c1-50-39-20-6-34(7-21-39)14-30-44-46(32-16-36-10-24-41(52-3)25-11-36)49-47(33-17-37-12-26-42(53-4)27-13-37)45(31-15-35-8-22-40(51-2)23-9-35)48(44)38-18-28-43(54-5)29-19-38/h6-13,18-29H,1-5H3
InChIKey NBGMYRFNXYPHBD-UHFFFAOYSA-N
SMILES C1(=C(C#CC2=CC=C(C=C2)OC)N=C(C#CC2=CC=C(C=C2)OC)C(C#CC2=CC=C(C=C2)OC)=C1C1=CC=C(C=C1)OC)C#CC1=CC=C(C=C1)OC