CID 28702595

2-methyl-2-[(2-methylpropyl)amino]propanenitrile

Structural Information

Molecular Formula
C8H16N2
SMILES
CC(C)CNC(C)(C)C#N
InChI
InChI=1S/C8H16N2/c1-7(2)5-10-8(3,4)6-9/h7,10H,5H2,1-4H3
InChIKey
IXICTGPBRRDJPC-UHFFFAOYSA-N
Compound name
2-methyl-2-(2-methylpropylamino)propanenitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

140.13135 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 141.13863 134.8
[M+Na]+ 163.12057 142.2
[M-H]- 139.12407 135.6
[M+NH4]+ 158.16517 154.2
[M+K]+ 179.09451 142.3
[M+H-H2O]+ 123.12861 123.7
[M+HCOO]- 185.12955 153.1
[M+CH3COO]- 199.14520 192.8
[M+Na-2H]- 161.10602 140.0
[M]+ 140.13080 129.8
[M]- 140.13190 129.8
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.