CID 52982895

15965-64-7

Structural Information

Molecular Formula

C₈H₆Cl₂N₂

SMILES

CN1C2=C(C=C(C=C2)Cl)N=C1Cl

InChI

InChI=1S/C8H6Cl2N2/c1-12-7-3-2-5(9)4-6(7)11-8(12)10/h2-4H,1H3

InChIKey

ZAMGXOKBQQMMOV-UHFFFAOYSA-N

Compound name

2,5-dichloro-1-methylbenzimidazole

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 199.9908 Da
Monoisotopic Mass: 3.4
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]+	200.99808	135.1
[M+Na]+	222.98002	152.1
[M+NH4]+	218.02462	145.2
[M+K]+	238.95396	145.2
[M-H]-	198.98352	137.3
[M+Na-2H]-	220.96547	143.1
[M]+	199.99025	138.9
[M]-	199.99135	138.9

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.