For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
5,5,6,6-Tetracyano-7,7-dimethylbicyclo[2.2.2]octan-2-one
SpectraBase Compound ID GDb5TsiSEne
InChI InChI=1S/C14H12N4O/c1-12(2)4-9-3-10(19)11(12)14(7-17,8-18)13(9,5-15)6-16/h9,11H,3-4H2,1-2H3/t9-,11+/m0/s1
InChIKey OBUHMWGMCDWZJV-GXSJLCMTSA-N
Mol Weight 252.28 g/mol
Molecular Formula C14H12N4O
Exact Mass 252.101111 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 8DIXqWbvq87
Name 5,5,6,6-Tetracyano-7,7-dimethylbicyclo[2.2.2]octan-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H12N4O
InChI InChI=1S/C14H12N4O/c1-12(2)4-9-3-10(19)11(12)14(7-17,8-18)13(9,5-15)6-16/h9,11H,3-4H2,1-2H3/t9-,11+/m0/s1
InChIKey OBUHMWGMCDWZJV-GXSJLCMTSA-N
Molecular Weight 252.277 g/mol
SMILES [C@]12(C(C[C@](C(C2(C#N)C#N)(C#N)C#N)(CC1(C)C)[H])=O)[H]
SPLASH splash10-001l-4900000000-17d196182af128adc53b
Source of Spectrum F-55-11463-21
Synonyms 5,5-Dimethyl-8-oxobicyclo[2.2.2]octane-2,2,3,3-tetracarbonitrile
Wiley ID 839409