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4-(4-Methoxyphenyl)-2,3,5,6-tetrakis(phenylethynyl)pyridine
SpectraBase Compound ID BcN5nGoG5bZ
InChI InChI=1S/C44H27NO/c1-46-39-28-26-38(27-29-39)44-40(30-22-34-14-6-2-7-15-34)42(32-24-36-18-10-4-11-19-36)45-43(33-25-37-20-12-5-13-21-37)41(44)31-23-35-16-8-3-9-17-35/h2-21,26-29H,1H3
InChIKey BJGHTXABSPAJKE-UHFFFAOYSA-N
Mol Weight 585.7 g/mol
Molecular Formula C44H27NO
Exact Mass 585.209264 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 96EGM7N0BEa
Name 4-(4-Methoxyphenyl)-2,3,5,6-tetrakis(phenylethynyl)pyridine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C44H27NO
InChI InChI=1S/C44H27NO/c1-46-39-28-26-38(27-29-39)44-40(30-22-34-14-6-2-7-15-34)42(32-24-36-18-10-4-11-19-36)45-43(33-25-37-20-12-5-13-21-37)41(44)31-23-35-16-8-3-9-17-35/h2-21,26-29H,1H3
InChIKey BJGHTXABSPAJKE-UHFFFAOYSA-N
Literature Reference DOI 10.1039/c4ob01292e
Molecular Weight 585.706 g/mol
SMILES c1(C#Cc2ccccc2)c(c(C#Cc2ccccc2)c(C#Cc2ccccc2)nc1C#Cc1ccccc1)-c1ccc(cc1)OC
SPLASH splash10-000i-0000190000-6a1ed32e3c9d47b65a64
Source of Spectrum F5-12-8636-10a
Wiley ID 1748267