CID 5127794

N,n'-bis(3,4-dichlorophenyl)formamidine

Structural Information

Molecular Formula
C13H8Cl4N2
SMILES
C1=CC(=C(C=C1NC=NC2=CC(=C(C=C2)Cl)Cl)Cl)Cl
InChI
InChI=1S/C13H8Cl4N2/c14-10-3-1-8(5-12(10)16)18-7-19-9-2-4-11(15)13(17)6-9/h1-7H,(H,18,19)
InChIKey
YOCJXLMFXFMEFF-UHFFFAOYSA-N
Compound name
N,N'-bis(3,4-dichlorophenyl)methanimidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

331.94415 Da
Monoisotopic Mass

5.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 332.95143 172.2
[M+Na]+ 354.93337 182.4
[M-H]- 330.93687 176.4
[M+NH4]+ 349.97797 187.4
[M+K]+ 370.90731 174.9
[M+H-H2O]+ 314.94141 167.2
[M+HCOO]- 376.94235 179.1
[M+CH3COO]- 390.95800 182.4
[M+Na-2H]- 352.91882 174.4
[M]+ 331.94360 175.1
[M]- 331.94470 175.1
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

patents stripe