CID 55285767

6-oxo-1,6-dihydropyridine-2-carboximidamide dihydrochloride

Structural Information

Molecular Formula
C6H7N3O
SMILES
C1=CC(=O)NC(=C1)C(=N)N
InChI
InChI=1S/C6H7N3O/c7-6(8)4-2-1-3-5(10)9-4/h1-3H,(H3,7,8)(H,9,10)
InChIKey
CLVWNQLVGYFASG-UHFFFAOYSA-N
Compound name
6-oxo-1H-pyridine-2-carboximidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

137.05891 Da
Monoisotopic Mass

-0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 138.066186 125.2
[M+Na]+ 160.048128 133.0
[M-H]- 136.051634 126.2
[M+NH4]+ 155.092733 144.0
[M+K]+ 176.022068 130.1
[M+H-H2O]+ 120.056170 118.9
[M+HCOO]- 182.057111 149.0
[M+CH3COO]- 196.072761 173.8
[M+Na-2H]- 158.033576 132.1
[M]+ 137.05836142 119.9
[M]- 137.05945858 119.9
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