CID 135783968

N'-hydroxypyrimidine-4-carboximidamide

Structural Information

Molecular Formula
C5H6N4O
SMILES
C1=CN=CN=C1/C(=N/O)/N
InChI
InChI=1S/C5H6N4O/c6-5(9-10)4-1-2-7-3-8-4/h1-3,10H,(H2,6,9)
InChIKey
CIUKLTPFGONSEC-UHFFFAOYSA-N
Compound name
N'-hydroxypyrimidine-4-carboximidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

138.05415 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 139.061426 125.3
[M+Na]+ 161.043368 132.8
[M-H]- 137.046874 126.1
[M+NH4]+ 156.087973 143.2
[M+K]+ 177.017308 131.5
[M+H-H2O]+ 121.051410 117.7
[M+HCOO]- 183.052351 149.5
[M+CH3COO]- 197.068001 175.0
[M+Na-2H]- 159.028816 134.2
[M]+ 138.05360142 122.3
[M]- 138.05469858 122.3
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