CID 264244

13865-25-3

Structural Information

Molecular Formula
C12H20N2
SMILES
CC(C)(CCCCC(C)(C)C#N)C#N
InChI
InChI=1S/C12H20N2/c1-11(2,9-13)7-5-6-8-12(3,4)10-14/h5-8H2,1-4H3
InChIKey
MZLDHJUKJGFOQQ-UHFFFAOYSA-N
Compound name
2,2,7,7-tetramethyloctanedinitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

192.16264 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 193.16992 169.0
[M+Na]+ 215.15186 175.6
[M+NH4]+ 210.19646 169.2
[M+K]+ 231.12580 166.0
[M-H]- 191.15536 157.4
[M+Na-2H]- 213.13731 166.7
[M]+ 192.16209 165.4
[M]- 192.16319 165.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.