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4-(pyridin-2-yl)benzonitrile
SpectraBase Compound ID B6PUajZznnx
InChI InChI=1S/C12H8N2/c13-9-10-4-6-11(7-5-10)12-3-1-2-8-14-12/h1-8H
InChIKey CCMRFUCSFRRPNT-UHFFFAOYSA-N
Mol Weight 180.21 g/mol
Molecular Formula C12H8N2
Exact Mass 180.068748 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BUKdjwLhG0E
Name 4-(pyridin-2-yl)benzonitrile
Appearance White solid
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Formula C12H8N2
InChI InChI=1S/C12H8N2/c13-9-10-4-6-11(7-5-10)12-3-1-2-8-14-12/h1-8H
InChIKey CCMRFUCSFRRPNT-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1021/acs.orglett.0c03939
Molecular Weight 180.210 g/mol
Reported Formula C12H8N2
SMILES c1(ncccc1)-c1ccc(cc1)C#N
SPLASH splash10-001i-0900000000-b0961ba0b5ad694ad3ea
Source of Spectrum A1-23-SM12-3i
Wiley ID 1854988