CID 21507395

4-aminobutanimidamide dihydrochloride

Structural Information

Molecular Formula
C4H11N3
SMILES
C(CC(=N)N)CN
InChI
InChI=1S/C4H11N3/c5-3-1-2-4(6)7/h1-3,5H2,(H3,6,7)
InChIKey
RKOPOQDWXOQCAB-UHFFFAOYSA-N
Compound name
4-aminobutanimidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

24
Patents

101.0953 Da
Monoisotopic Mass

-1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 102.10258 121.1
[M+Na]+ 124.08452 126.6
[M-H]- 100.08802 120.6
[M+NH4]+ 119.12912 142.7
[M+K]+ 140.05846 125.9
[M+H-H2O]+ 84.092560 115.7
[M+HCOO]- 146.09350 146.4
[M+CH3COO]- 160.10915 174.4
[M+Na-2H]- 122.06997 126.3
[M]+ 101.09475 115.7
[M]- 101.09585 115.7
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