CID 89267268

4-aminopiperidine-1-carbonitrile

Structural Information

Molecular Formula
C6H11N3
SMILES
C1CN(CCC1N)C#N
InChI
InChI=1S/C6H11N3/c7-5-9-3-1-6(8)2-4-9/h6H,1-4,8H2
InChIKey
HDMMHAPXDUDRBN-UHFFFAOYSA-N
Compound name
4-aminopiperidine-1-carbonitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

125.0953 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 126.10258 124.4
[M+Na]+ 148.08452 132.1
[M-H]- 124.08802 125.5
[M+NH4]+ 143.12912 142.6
[M+K]+ 164.05846 130.3
[M+H-H2O]+ 108.09256 111.8
[M+HCOO]- 170.09350 141.4
[M+CH3COO]- 184.10915 185.6
[M+Na-2H]- 146.06997 129.7
[M]+ 125.09475 113.7
[M]- 125.09585 113.7
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