CID 79223

2-hydrazinobenzoic acid

Structural Information

Molecular Formula

C₇H₈N₂O₂

SMILES

C1=CC=C(C(=C1)C(=O)O)NN

InChI

InChI=1S/C7H8N2O2/c8-9-6-4-2-1-3-5(6)7(10)11/h1-4,9H,8H2,(H,10,11)

InChIKey

KFGVDCBVGNMCJC-UHFFFAOYSA-N

Compound name

2-hydrazinylbenzoic acid

Related CIDs

2D Structure

compound 2d structure

3
Annotation Hits: 3
References: 1495
Patents: 152.05858 Da
Monoisotopic Mass: -1.0
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]+	153.065856	128.7
[M+Na]+	175.047798	135.7
[M-H]-	151.051304	131.0
[M+NH4]+	170.092403	148.2
[M+K]+	191.021738	133.8
[M+H-H2O]+	135.055840	122.9
[M+HCOO]-	197.056781	153.5
[M+CH3COO]-	211.072431	177.1
[M+Na-2H]-	173.033246	135.0
[M]+	152.05803142	125.4
[M]-	152.05912858	125.4

Literature stripe

literature stripe

Patent stripe

patents stripe