CID 3782617

6-hydrazinonicotinic acid

Structural Information

Molecular Formula

C₆H₇N₃O₂

SMILES

C1=CC(=NC=C1C(=O)O)NN

InChI

InChI=1S/C6H7N3O2/c7-9-5-2-1-4(3-8-5)6(10)11/h1-3H,7H2,(H,8,9)(H,10,11)

InChIKey

HBBSDZXXUIHKJE-UHFFFAOYSA-N

Compound name

6-hydrazinylpyridine-3-carboxylic acid

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 54
References: 1563
Patents: 153.05383 Da
Monoisotopic Mass: -2.3
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]+	154.061106	128.5
[M+Na]+	176.043048	135.9
[M-H]-	152.046554	129.5
[M+NH4]+	171.087653	146.6
[M+K]+	192.016988	134.2
[M+H-H2O]+	136.051090	121.9
[M+HCOO]-	198.052031	152.4
[M+CH3COO]-	212.067681	176.8
[M+Na-2H]-	174.028496	135.5
[M]+	153.05328142	125.3
[M]-	153.05437858	125.3

Literature stripe

literature stripe

Patent stripe

patents stripe