CID 209487

2h-benzimidazol-2-one, 1,3-dihydro-6-chloro-1-(4-chlorophenyl)-

Structural Information

Molecular Formula
C13H8Cl2N2O
SMILES
C1=CC(=CC=C1N2C3=C(C=CC(=C3)Cl)NC2=O)Cl
InChI
InChI=1S/C13H8Cl2N2O/c14-8-1-4-10(5-2-8)17-12-7-9(15)3-6-11(12)16-13(17)18/h1-7H,(H,16,18)
InChIKey
RZKDANBEMUEGFO-UHFFFAOYSA-N
Compound name
5-chloro-3-(4-chlorophenyl)-1H-benzimidazol-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

278.00137 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 279.008646 156.7
[M+Na]+ 300.990588 170.6
[M-H]- 276.994094 160.8
[M+NH4]+ 296.035193 174.1
[M+K]+ 316.964528 162.3
[M+H-H2O]+ 260.998630 149.7
[M+HCOO]- 322.999571 169.6
[M+CH3COO]- 337.015221 169.5
[M+Na-2H]- 298.976036 161.6
[M]+ 278.00082142 161.1
[M]- 278.00191858 161.1
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

patents stripe