CID 211742

23557-71-3

Structural Information

Molecular Formula
C13H9Cl3N2
SMILES
C1=CC=C(C(=C1)C(=NC2=CC(=C(C=C2)Cl)Cl)N)Cl
InChI
InChI=1S/C13H9Cl3N2/c14-10-4-2-1-3-9(10)13(17)18-8-5-6-11(15)12(16)7-8/h1-7H,(H2,17,18)
InChIKey
WFYFVRIWRBHXLL-UHFFFAOYSA-N
Compound name
2-chloro-N'-(3,4-dichlorophenyl)benzenecarboximidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

297.98312 Da
Monoisotopic Mass

4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 298.99040 164.5
[M+Na]+ 320.97234 174.2
[M-H]- 296.97584 170.1
[M+NH4]+ 316.01694 181.0
[M+K]+ 336.94628 166.9
[M+H-H2O]+ 280.98038 159.2
[M+HCOO]- 342.98132 175.9
[M+CH3COO]- 356.99697 206.5
[M+Na-2H]- 318.95779 167.0
[M]+ 297.98257 166.4
[M]- 297.98367 166.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.