CID 15546

Chloridazon

Structural Information

Molecular Formula

C₁₀H₈ClN₃O

SMILES

C1=CC=C(C=C1)N2C(=O)C(=C(C=N2)N)Cl

InChI

InChI=1S/C10H8ClN3O/c11-9-8(12)6-13-14(10(9)15)7-4-2-1-3-5-7/h1-6H,12H2

InChIKey

WYKYKTKDBLFHCY-UHFFFAOYSA-N

Compound name

5-amino-4-chloro-2-phenylpyridazin-3-one

Related CIDs

2D Structure

compound 2d structure

7
Annotation Hits: 73
References: 24426
Patents: 221.03558 Da
Monoisotopic Mass: 0.8
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]+	222.04286	144.0
[M+Na]+	244.02480	160.3
[M+NH4]+	239.06940	152.4
[M+K]+	259.99874	152.7
[M-H]-	220.02830	148.0
[M+Na-2H]-	242.01025	153.9
[M]+	221.03503	147.8
[M]-	221.03613	147.8

Literature stripe

literature stripe

Patent stripe

patents stripe