CID 89052616

1-(4-aminopyridin-2-yl)azetidin-3-ol

Structural Information

Molecular Formula
C8H11N3O
SMILES
C1C(CN1C2=NC=CC(=C2)N)O
InChI
InChI=1S/C8H11N3O/c9-6-1-2-10-8(3-6)11-4-7(12)5-11/h1-3,7,12H,4-5H2,(H2,9,10)
InChIKey
FHKIMCAYCMRMFO-UHFFFAOYSA-N
Compound name
1-(4-aminopyridin-2-yl)azetidin-3-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

165.09021 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 166.09749 134.7
[M+Na]+ 188.07943 141.4
[M-H]- 164.08293 137.0
[M+NH4]+ 183.12403 145.1
[M+K]+ 204.05337 141.8
[M+H-H2O]+ 148.08747 121.6
[M+HCOO]- 210.08841 154.2
[M+CH3COO]- 224.10406 181.2
[M+Na-2H]- 186.06488 140.3
[M]+ 165.08966 139.6
[M]- 165.09076 139.6
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