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5,6-Bis(4-tert-butylphenylethynyl)pyrazine-2,3-dicarbonitrile
SpectraBase Compound ID F3Zeqm0RLXd
InChI InChI=1S/C30H26N4/c1-29(2,3)23-13-7-21(8-14-23)11-17-25-26(34-28(20-32)27(19-31)33-25)18-12-22-9-15-24(16-10-22)30(4,5)6/h7-10,13-16H,1-6H3
InChIKey SJUOYZGOZUNMSK-UHFFFAOYSA-N
Mol Weight 442.57 g/mol
Molecular Formula C30H26N4
Exact Mass 442.215747 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EcPaDXa4hIw
Name 5,6-Bis(4-tert-butylphenylethynyl)pyrazine-2,3-dicarbonitrile
Alternate Name(s) 5,6-bis[(4-tert-butylphenyl)ethynyl]-2,3-pyrazinedicarbonitrile
Comments Less than 3 mono-isotopic peaks
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Formula C30H26N4
InChI InChI=1S/C30H26N4/c1-29(2,3)23-13-7-21(8-14-23)11-17-25-26(34-28(20-32)27(19-31)33-25)18-12-22-9-15-24(16-10-22)30(4,5)6/h7-10,13-16H,1-6H3
InChIKey SJUOYZGOZUNMSK-UHFFFAOYSA-N
Molecular Weight 442.566 g/mol
SMILES c1(nc(c(nc1C#N)C#Cc1ccc(C(C)(C)C)cc1)C#Cc1ccc(C(C)(C)C)cc1)C#N
SPLASH splash10-004l-0000900000-28bb7d8dd0a63d3bc0d0
Source of Spectrum K1-2004-1141-3
Wiley ID 1560511