CID 434784

Thiazole, 2,2'-(2,6-dichlorobenzylidenediimino)di-

Structural Information

Molecular Formula
C13H10Cl2N4S2
SMILES
C1=CC(=C(C(=C1)Cl)C(NC2=NC=CS2)NC3=NC=CS3)Cl
InChI
InChI=1S/C13H10Cl2N4S2/c14-8-2-1-3-9(15)10(8)11(18-12-16-4-6-20-12)19-13-17-5-7-21-13/h1-7,11H,(H,16,18)(H,17,19)
InChIKey
JGWRKZKUHYVHOA-UHFFFAOYSA-N
Compound name
1-(2,6-dichlorophenyl)-N,N'-bis(1,3-thiazol-2-yl)methanediamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

355.97238 Da
Monoisotopic Mass

5.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 356.97966 173.7
[M+Na]+ 378.96160 185.1
[M-H]- 354.96510 182.0
[M+NH4]+ 374.00620 189.5
[M+K]+ 394.93554 177.5
[M+H-H2O]+ 338.96964 167.4
[M+HCOO]- 400.97058 181.4
[M+CH3COO]- 414.98623 185.0
[M+Na-2H]- 376.94705 173.2
[M]+ 355.97183 179.5
[M]- 355.97293 179.5
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.