CID 5745591

Pyridine, 2-nitroamino-, potassium salt

Structural Information

Molecular Formula
C5H4N3O2
SMILES
C1=CC=NC(=C1)[N-][N+](=O)[O-]
InChI
InChI=1S/C5H4N3O2/c9-8(10)7-5-3-1-2-4-6-5/h1-4H/q-1
InChIKey
BVPJQGNCMRSQLF-UHFFFAOYSA-N
Compound name
nitro(pyridin-2-yl)azanide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

138.03035 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 139.037626 122.3
[M+Na]+ 161.019568 129.1
[M-H]- 137.023074 124.5
[M+NH4]+ 156.064173 141.0
[M+K]+ 176.993508 125.1
[M+H-H2O]+ 121.027610 122.3
[M+HCOO]- 183.028551 149.5
[M+CH3COO]- 197.044201 168.7
[M+Na-2H]- 159.005016 133.1
[M]+ 138.02980142 118.7
[M]- 138.03089858 118.7
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