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]+ 332.951426 172.2
[M+Na]+ 354.933368 182.4
[M-H]- 330.936874 176.4
[M+NH4]+ 349.977973 187.4
[M+K]+ 370.907308 174.9
[M+H-H2O]+ 314.941410 167.2
[M+HCOO]- 376.942351 179.1
[M+CH3COO]- 390.958001 182.4
[M+Na-2H]- 352.918816 174.4
[M]+ 331.94360142 175.1
[M]- 331.94469858 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