CID 15683375

2-amino-2,3,3-trimethylbutanenitrile

Structural Information

Molecular Formula
C7H14N2
SMILES
CC(C)(C)C(C)(C#N)N
InChI
InChI=1S/C7H14N2/c1-6(2,3)7(4,9)5-8/h9H2,1-4H3
InChIKey
RYHBMXCSCBXLJT-UHFFFAOYSA-N
Compound name
2-amino-2,3,3-trimethylbutanenitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

16
Patents

126.1157 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 127.12298 133.5
[M+Na]+ 149.10492 141.9
[M-H]- 125.10842 134.3
[M+NH4]+ 144.14952 153.4
[M+K]+ 165.07886 142.0
[M+H-H2O]+ 109.11296 123.2
[M+HCOO]- 171.11390 151.0
[M+CH3COO]- 185.12955 188.5
[M+Na-2H]- 147.09037 139.7
[M]+ 126.11515 127.3
[M]- 126.11625 127.3
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

patents stripe