CID 3061792

79759-66-3

Structural Information

Molecular Formula
C14H10Cl2N2O
SMILES
CN1C2=C(C=C(C=C2)Cl)N(C1=O)C3=CC=C(C=C3)Cl
InChI
InChI=1S/C14H10Cl2N2O/c1-17-12-7-4-10(16)8-13(12)18(14(17)19)11-5-2-9(15)3-6-11/h2-8H,1H3
InChIKey
TUBSJVSBJVGBMD-UHFFFAOYSA-N
Compound name
5-chloro-3-(4-chlorophenyl)-1-methylbenzimidazol-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

292.01703 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 293.02431 160.5
[M+Na]+ 315.00625 179.6
[M+NH4]+ 310.05085 170.0
[M+K]+ 330.98019 171.5
[M-H]- 291.00975 164.8
[M+Na-2H]- 312.99170 169.8
[M]+ 292.01648 165.4
[M]- 292.01758 165.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.