CID 71211

Nicoxamat

Structural Information

Molecular Formula
C6H6N2O2
SMILES
C1=CC(=CN=C1)C(=O)NO
InChI
InChI=1S/C6H6N2O2/c9-6(8-10)5-2-1-3-7-4-5/h1-4,10H,(H,8,9)
InChIKey
IYCHDNQCHLMLJZ-UHFFFAOYSA-N
Compound name
N-hydroxypyridine-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

10
References

850
Patents

138.04292 Da
Monoisotopic Mass

-0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 139.05020 125.6
[M+Na]+ 161.03214 136.9
[M+NH4]+ 156.07674 133.0
[M+K]+ 177.00608 132.2
[M-H]- 137.03564 126.4
[M+Na-2H]- 159.01759 132.3
[M]+ 138.04237 127.1
[M]- 138.04347 127.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe