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2,5,7,10-tetrakis{Phenylethynyl)bicyclo[4.4.1]undeca-1,3,5,7,9-pentaene
SpectraBase Compound ID EyaQVkOPa0w
InChI InChI=1S/C43H26/c1-5-13-34(14-6-1)21-25-38-29-30-40(27-23-36-17-9-3-10-18-36)43-33-42(38)39(26-22-35-15-7-2-8-16-35)31-32-41(43)28-24-37-19-11-4-12-20-37/h1-20,29-32H,33H2
InChIKey SKSOHYVRYOTHEO-UHFFFAOYSA-N
Mol Weight 542.7 g/mol
Molecular Formula C43H26
Exact Mass 542.203451 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ImL0odpJVce
Name 2,5,7,10-tetrakis{Phenylethynyl)bicyclo[4.4.1]undeca-1,3,5,7,9-pentaene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C43H26
InChI InChI=1S/C43H26/c1-5-13-34(14-6-1)21-25-38-29-30-40(27-23-36-17-9-3-10-18-36)43-33-42(38)39(26-22-35-15-7-2-8-16-35)31-32-41(43)28-24-37-19-11-4-12-20-37/h1-20,29-32H,33H2
InChIKey SKSOHYVRYOTHEO-UHFFFAOYSA-N
Molecular Weight 542.681 g/mol
SMILES C=12C(C#Cc3ccccc3)=CC=C(C#Cc3ccccc3)C(C2)=C(C#Cc2ccccc2)C=CC1C#Cc1ccccc1
SPLASH splash10-0296-0000970000-018a43a0528eeea878bb
Source of Spectrum K-127-1526-3
Wiley ID 1404915