CID 12312228

5-hydroxy-1h-indazole-3-carboxylic acid

Structural Information

Molecular Formula

C₈H₆N₂O₃

SMILES

C1=CC2=C(C=C1O)C(=NN2)C(=O)O

InChI

InChI=1S/C8H6N2O3/c11-4-1-2-6-5(3-4)7(8(12)13)10-9-6/h1-3,11H,(H,9,10)(H,12,13)

InChIKey

FAWRWXHECPLDFD-UHFFFAOYSA-N

Compound name

5-hydroxy-1H-indazole-3-carboxylic acid

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 10
Patents: 178.03784 Da
Monoisotopic Mass: 1.1
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]+	179.04512	134.1
[M+Na]+	201.02706	146.0
[M+NH4]+	196.07166	140.6
[M+K]+	217.00100	143.9
[M-H]-	177.03056	132.8
[M+Na-2H]-	199.01251	138.4
[M]+	178.03729	135.0
[M]-	178.03839	135.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe