CID 147392

1-aminopiperazine

Structural Information

Molecular Formula
C4H11N3
SMILES
C1CN(CCN1)N
InChI
InChI=1S/C4H11N3/c5-7-3-1-6-2-4-7/h6H,1-5H2
InChIKey
IYPZRUYMFDWKSS-UHFFFAOYSA-N
Compound name
piperazin-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

38
References

4122
Patents

101.0953 Da
Monoisotopic Mass

-1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 102.10258 121.3
[M+Na]+ 124.08452 126.5
[M-H]- 100.08802 119.6
[M+NH4]+ 119.12912 140.2
[M+K]+ 140.05846 125.0
[M+H-H2O]+ 84.092560 114.5
[M+HCOO]- 146.09350 139.4
[M+CH3COO]- 160.10915 164.1
[M+Na-2H]- 122.06997 127.9
[M]+ 101.09475 112.5
[M]- 101.09585 112.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe