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1,4-Bis(4'-t-butyl-2'-ethynylphenylethynyl)benzene
SpectraBase Compound ID EueJxUJpO1f
InChI InChI=1S/C34H30/c1-9-27-23-31(33(3,4)5)21-19-29(27)17-15-25-11-13-26(14-12-25)16-18-30-20-22-32(34(6,7)8)24-28(30)10-2/h1-2,11-14,19-24H,3-8H3
InChIKey DPAKXPDWWSMSQA-UHFFFAOYSA-N
Mol Weight 438.6 g/mol
Molecular Formula C34H30
Exact Mass 438.234751 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E9HP2UoLbE9
Name 1,4-Bis(4'-t-butyl-2'-ethynylphenylethynyl)benzene
Alternate Name(s) 4-tert-butyl-1-({4-[(4-tert-butyl-2-ethynylphenyl)ethynyl]phenyl}ethynyl)-2-ethynylbenzene
Comments Less than 3 mono-isotopic peaks
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Formula C34H30
InChI InChI=1S/C34H30/c1-9-27-23-31(33(3,4)5)21-19-29(27)17-15-25-11-13-26(14-12-25)16-18-30-20-22-32(34(6,7)8)24-28(30)10-2/h1-2,11-14,19-24H,3-8H3
InChIKey DPAKXPDWWSMSQA-UHFFFAOYSA-N
Molecular Weight 438.614 g/mol
SMILES C(#Cc1ccc(C#Cc2c(C#C)cc(cc2)C(C)(C)C)cc1)c1c(C#C)cc(cc1)C(C)(C)C
SPLASH splash10-0079-0000900000-3c964c5f4d1c7a7ff748
Source of Spectrum QE-12-7113-22
Wiley ID 1587325