CID 1870972

2-[(3-aminopyridin-4-yl)amino]ethan-1-ol

Structural Information

Molecular Formula
C7H11N3O
SMILES
C1=CN=CC(=C1NCCO)N
InChI
InChI=1S/C7H11N3O/c8-6-5-9-2-1-7(6)10-3-4-11/h1-2,5,11H,3-4,8H2,(H,9,10)
InChIKey
MKFUJNJNKHEQTE-UHFFFAOYSA-N
Compound name
2-[(3-aminopyridin-4-yl)amino]ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

11
Patents

153.09021 Da
Monoisotopic Mass

-0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 154.09749 130.5
[M+Na]+ 176.07943 137.6
[M-H]- 152.08293 131.2
[M+NH4]+ 171.12403 148.9
[M+K]+ 192.05337 135.1
[M+H-H2O]+ 136.08747 123.8
[M+HCOO]- 198.08841 154.6
[M+CH3COO]- 212.10406 177.7
[M+Na-2H]- 174.06488 138.3
[M]+ 153.08966 127.6
[M]- 153.09076 127.6
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