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2-(5-butyl-2-pyridinyl)-5-[2-(1-ethynyl-3-bicyclo[1.1.1]pentanyl)ethynyl]pyridine
SpectraBase Compound ID 63smaTnSD4P
InChI InChI=1S/C23H22N2/c1-3-5-6-18-7-9-20(24-13-18)21-10-8-19(14-25-21)11-12-23-15-22(4-2,16-23)17-23/h2,7-10,13-14H,3,5-6,15-17H2,1H3
InChIKey DZRRIGAEXTWOBO-UHFFFAOYSA-N
Mol Weight 326.44 g/mol
Molecular Formula C23H22N2
Exact Mass 326.178299 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3W0NwqnvBw
Name 2-(5-butyl-2-pyridinyl)-5-[2-(1-ethynyl-3-bicyclo[1.1.1]pentanyl)ethynyl]pyridine
Alternate Name(s) 2-(5-butyl-2-pyridyl)-5-[2-(1-ethynyl-3-bicyclo[1.1.1]pentanyl)ethynyl]pyridine 2-(5-butylpyridin-2-yl)-5-[2-(1-ethynyl-3-bicyclo[1.1.1]pentanyl)ethynyl]pyridine
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Formula C23H22N2
InChI InChI=1S/C23H22N2/c1-3-5-6-18-7-9-20(24-13-18)21-10-8-19(14-25-21)11-12-23-15-22(4-2,16-23)17-23/h2,7-10,13-14H,3,5-6,15-17H2,1H3
InChIKey DZRRIGAEXTWOBO-UHFFFAOYSA-N
Molecular Weight 326.443 g/mol
SMILES C12(C#Cc3cnc(cc3)-c3ncc(cc3)CCCC)CC(C2)(C#C)C1
SPLASH splash10-0059-0169000000-365cbff7fbbf1f2528eb
Source of Spectrum J-67-5482-21
Wiley ID 1570497