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2-[5-[2-(1-ethynyl-3-bicyclo[1.1.1]pentanyl)ethynyl]-2-pyridinyl]-5-hexylpyridine
SpectraBase Compound ID LfKrnzsYr3u
InChI InChI=1S/C25H26N2/c1-3-5-6-7-8-20-9-11-22(26-15-20)23-12-10-21(16-27-23)13-14-25-17-24(4-2,18-25)19-25/h2,9-12,15-16H,3,5-8,17-19H2,1H3
InChIKey XOHFOOHLNRMDMV-UHFFFAOYSA-N
Mol Weight 354.5 g/mol
Molecular Formula C25H26N2
Exact Mass 354.209599 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2vycei5MZM
Name 2-[5-[2-(1-ethynyl-3-bicyclo[1.1.1]pentanyl)ethynyl]-2-pyridinyl]-5-hexylpyridine
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Formula C25H26N2
InChI InChI=1S/C25H26N2/c1-3-5-6-7-8-20-9-11-22(26-15-20)23-12-10-21(16-27-23)13-14-25-17-24(4-2,18-25)19-25/h2,9-12,15-16H,3,5-8,17-19H2,1H3
InChIKey XOHFOOHLNRMDMV-UHFFFAOYSA-N
Molecular Weight 354.497 g/mol
SMILES C12(C#Cc3cnc(cc3)-c3ncc(cc3)CCCCCC)CC(C2)(C#C)C1
SPLASH splash10-0udi-1169000000-63eff2bd172b4fbdd85c
Source of Spectrum J-67-5482-22
Synonyms 2-[5-[2-(1-ethynyl-3-bicyclo[1.1.1]pentanyl)ethynyl]-2-pyridyl]-5-hexyl-pyridine 2-[5-[2-(1-ethynyl-3-bicyclo[1.1.1]pentanyl)ethynyl]pyridin-2-yl]-5-hexyl-pyridine
Wiley ID 1570496