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

14
Patents

126.1157 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 127.122976 133.5
[M+Na]+ 149.104918 141.9
[M-H]- 125.108424 134.3
[M+NH4]+ 144.149523 153.4
[M+K]+ 165.078858 142.0
[M+H-H2O]+ 109.112960 123.2
[M+HCOO]- 171.113901 151.0
[M+CH3COO]- 185.129551 188.5
[M+Na-2H]- 147.090366 139.7
[M]+ 126.11515142 127.3
[M]- 126.11624858 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