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1,3,5-tris[2-(3',5'-Dimethylphenyl)ethynyl]-benzene
SpectraBase Compound ID 4FV48nNTswZ
InChI InChI=1S/C36H30/c1-25-13-26(2)17-31(16-25)7-10-34-22-35(11-8-32-18-27(3)14-28(4)19-32)24-36(23-34)12-9-33-20-29(5)15-30(6)21-33/h13-24H,1-6H3
InChIKey YLPCTPHAXQWLQO-UHFFFAOYSA-N
Mol Weight 462.6 g/mol
Molecular Formula C36H30
Exact Mass 462.234751 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BIyTYybUHKI
Name 1,3,5-tris[2-(3',5'-Dimethylphenyl)ethynyl]-benzene
Alternate Name(s) 1,3,5-tris[(3,5-dimethylphenyl)ethynyl]benzene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C36H30
InChI InChI=1S/C36H30/c1-25-13-26(2)17-31(16-25)7-10-34-22-35(11-8-32-18-27(3)14-28(4)19-32)24-36(23-34)12-9-33-20-29(5)15-30(6)21-33/h13-24H,1-6H3
InChIKey YLPCTPHAXQWLQO-UHFFFAOYSA-N
Molecular Weight 462.636 g/mol
SMILES C(#Cc1cc(C)cc(c1)C)c1cc(C#Cc2cc(C)cc(c2)C)cc(C#Cc2cc(C)cc(c2)C)c1
SPLASH splash10-03di-0000900000-555e961f5b2fae03b544
Source of Spectrum D1-2006-2918-11
Wiley ID 1614262