CID 6320119

Schembl29044976

Structural Information

Molecular Formula

C₆H₆N₂O₃

SMILES

C1=CNC(=CC1=O)C(=O)NO

InChI

InChI=1S/C6H6N2O3/c9-4-1-2-7-5(3-4)6(10)8-11/h1-3,11H,(H,7,9)(H,8,10)

InChIKey

YLHPMCVQZICIJJ-UHFFFAOYSA-N

Compound name

N-hydroxy-4-oxo-1H-pyridine-2-carboxamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 154.03784 Da
Monoisotopic Mass: -0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	155.045116	127.3
[M+Na]+	177.027058	135.4
[M-H]-	153.030564	127.5
[M+NH4]+	172.071663	145.3
[M+K]+	193.000998	133.1
[M+H-H2O]+	137.035100	121.2
[M+HCOO]-	199.036041	149.6
[M+CH3COO]-	213.051691	170.5
[M+Na-2H]-	175.012506	134.5
[M]+	154.03729142	124.6
[M]-	154.03838858	124.6

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe