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2-Cyano-3-(4'-cyanobuta-1',3'-diynyl)-5,6 : 7,8-dibenzobicyclo[2.2.2]oct-2-ene
SpectraBase Compound ID 9n6PA7zrK8e
InChI InChI=1S/C22H10N2/c23-13-7-1-2-8-19-20(14-24)22-17-11-5-3-9-15(17)21(19)16-10-4-6-12-18(16)22/h3-6,9-12,21-22H/t21-,22+
InChIKey OWODHBHWVXFTTL-SZPZYZBQSA-N
Mol Weight 302.34 g/mol
Molecular Formula C22H10N2
Exact Mass 302.084398 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2ZEmPeAB3j1
Name 2-Cyano-3-(4'-cyanobuta-1',3'-diynyl)-5,6 : 7,8-dibenzobicyclo[2.2.2]oct-2-ene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H10N2
InChI InChI=1S/C22H10N2/c23-13-7-1-2-8-19-20(14-24)22-17-11-5-3-9-15(17)21(19)16-10-4-6-12-18(16)22/h3-6,9-12,21-22H/t21-,22+
InChIKey OWODHBHWVXFTTL-SZPZYZBQSA-N
Molecular Weight 302.336 g/mol
SMILES C1(=C([C@]2(c3ccccc3[C@@]1(c1ccccc21)[H])[H])C#N)C#CC#CC#N
SPLASH splash10-0ufr-0319000000-449afe8f6d5e0ea600e9
Source of Spectrum U1-1999-2499-28
Wiley ID 753683