CID 19055

4-aminopyridine 1-oxide

Structural Information

Molecular Formula
C5H6N2O
SMILES
C1=CN(C=CC1=N)O
InChI
InChI=1S/C5H6N2O/c6-5-1-3-7(8)4-2-5/h1-4,6,8H
InChIKey
SJQWWHFNDOUAGY-UHFFFAOYSA-N
Compound name
1-hydroxypyridin-4-imine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

90
Patents

110.04801 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 111.05529 116.8
[M+Na]+ 133.03723 125.9
[M-H]- 109.04073 118.4
[M+NH4]+ 128.08183 137.5
[M+K]+ 149.01117 123.7
[M+H-H2O]+ 93.045270 111.1
[M+HCOO]- 155.04621 141.3
[M+CH3COO]- 169.06186 166.3
[M+Na-2H]- 131.02268 126.3
[M]+ 110.04746 114.2
[M]- 110.04856 114.2
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

No patent data available for this compound.