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2-[2-[3,5-bis[2-(4-tert-butyl-2,6-divinyl-phenyl)ethynyl]phenyl]ethynyl]-5-tert-butyl-1,3-divinyl-benzene
SpectraBase Compound ID CCcZA7ejJVa
InChI InChI=1S/C54H54/c1-16-40-31-46(52(7,8)9)32-41(17-2)49(40)25-22-37-28-38(23-26-50-42(18-3)33-47(53(10,11)12)34-43(50)19-4)30-39(29-37)24-27-51-44(20-5)35-48(54(13,14)15)36-45(51)21-6/h16-21,28-36H,1-6H2,7-15H3
InChIKey BKZMBXKIQRPGLV-UHFFFAOYSA-N
Mol Weight 703.0 g/mol
Molecular Formula C54H54
Exact Mass 702.422552 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3StBtv0DzMX
Name 2-[2-[3,5-bis[2-(4-tert-butyl-2,6-divinyl-phenyl)ethynyl]phenyl]ethynyl]-5-tert-butyl-1,3-divinyl-benzene
Alternate Name(s) 2-[2-[3,5-bis[2-[4-tert-butyl-2,6-bis(ethenyl)phenyl]ethynyl]phenyl]ethynyl]-5-tert-butyl-1,3-bis(ethenyl)benzene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C54H54
InChI InChI=1S/C54H54/c1-16-40-31-46(52(7,8)9)32-41(17-2)49(40)25-22-37-28-38(23-26-50-42(18-3)33-47(53(10,11)12)34-43(50)19-4)30-39(29-37)24-27-51-44(20-5)35-48(54(13,14)15)36-45(51)21-6/h16-21,28-36H,1-6H2,7-15H3
InChIKey BKZMBXKIQRPGLV-UHFFFAOYSA-N
Molecular Weight 703.026 g/mol
SMILES C(c1c(cc(cc1C=C)C(C)(C)C)C=C)#Cc1cc(C#Cc2c(cc(cc2C=C)C(C)(C)C)C=C)cc(C#Cc2c(cc(cc2C=C)C(C)(C)C)C=C)c1
SPLASH splash10-0a4r-9000027100-29f6eb0229570e4f1a5d
Source of Spectrum H-2005-2744-4
Wiley ID 1563016