CID 22451730

4-(2-aminoethyl)pyridin-2-amine dihydrochloride

Structural Information

Molecular Formula
C7H11N3
SMILES
C1=CN=C(C=C1CCN)N
InChI
InChI=1S/C7H11N3/c8-3-1-6-2-4-10-7(9)5-6/h2,4-5H,1,3,8H2,(H2,9,10)
InChIKey
GOTXDZNTMYPRFN-UHFFFAOYSA-N
Compound name
4-(2-aminoethyl)pyridin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

59
Patents

137.09529 Da
Monoisotopic Mass

-0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 138.102566 127.6
[M+Na]+ 160.084508 135.2
[M-H]- 136.088014 129.2
[M+NH4]+ 155.129113 147.2
[M+K]+ 176.058448 132.8
[M+H-H2O]+ 120.092550 120.9
[M+HCOO]- 182.093491 152.4
[M+CH3COO]- 196.109141 177.4
[M+Na-2H]- 158.069956 134.8
[M]+ 137.09474142 124.2
[M]- 137.09583858 124.2
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