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2-(2-tert-Butyl-3,3-dimethylbut-1-enyl)-5-(6-tert-butyl-7,7-dimethyloct-5-ene-1,3-diynyl)thiophene
SpectraBase Compound ID HmIzKj1FDAl
InChI InChI=1S/C28H40S/c1-25(2,3)23(26(4,5)6)17-15-13-14-16-21-18-19-22(29-21)20-24(27(7,8)9)28(10,11)12/h17-20H,1-12H3
InChIKey JDNDFGBLULDWDK-UHFFFAOYSA-N
Mol Weight 408.7 g/mol
Molecular Formula C28H40S
Exact Mass 408.285072 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FQILODoTBc
Name 2-(2-tert-Butyl-3,3-dimethylbut-1-enyl)-5-(6-tert-butyl-7,7-dimethyloct-5-ene-1,3-diynyl)thiophene
Alternate Name(s) 2-(2-tert-butyl-3,3-dimethylbut-1-enyl)-5-(6-tert-butyl-7,7-dimethyloct-5-en-1,3-diynyl)thiophene
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Formula C28H40S
InChI InChI=1S/C28H40S/c1-25(2,3)23(26(4,5)6)17-15-13-14-16-21-18-19-22(29-21)20-24(27(7,8)9)28(10,11)12/h17-20H,1-12H3
InChIKey JDNDFGBLULDWDK-UHFFFAOYSA-N
Molecular Weight 408.688 g/mol
SMILES C(=Cc1sc(C#CC#CC=C(C(C)(C)C)C(C)(C)C)cc1)(C(C)(C)C)C(C)(C)C
SPLASH splash10-0pb9-2029800000-b76191cc1fb1b6829988
Source of Spectrum U1-2010-4045-31
Wiley ID 1664064